9950 SMILES Strings for 5-hydroxytryptamine receptor 2A

Compound Name
SMILES String
NC(=O)OC(CCCN1CCN(CC1)c1ccccn1)c1ccccc1
NC(=O)OC(CCCN1CCN(CC1)c1ncccc1Cl)c1ccccc1
COc1ccc(cc1)N1CCN(CCC[C@@H](OC(N)=O)c2ccccc2)CC1 |r|
Cc1nc(C(=O)NCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
CCc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Br)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
CSc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
COc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
Cc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CC(=O)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
Oc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
O=C(CCCCCN1CCN(CC1)c1ccccc1)NC1CCCc2ccccc12
[O-][N+](=O)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
Clc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
O=C(CCCCCN1CCN(CC1)c1ccccc1C#N)NC1CCCc2ccccc12
NC(=O)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CS(=O)(=O)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CCc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CCCc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CC(C)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
O=C(CCCCCN1CCN(CC1)c1ccccc1-c1ccccc1)NC1CCCc2ccccc12
CN(C)c1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CNc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
CC(=O)Nc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
Fc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
O=C(CCCCCN1CCN(CC1)c1ccccn1)NC1CCCc2ccccc12
c1ccc2c(c1)C(=O)N(C(=O)N2)CCN3CCC(CC3)C(=O)c4ccc(cc4)F
CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12 |t:8|
CN(C)CCOC1=Cc2ccccc2Sc3c1cc(cc3)Cl
CN1CCN2c3ccccc3Cc4ccccc4[C@H]2C1
CN(C)CCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CCN(C)CCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
NCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CNCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CCNCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CCCNCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CC(C)NCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
O=S(=O)(c1c[nH]c2cccc(CCNC3CCCC3)c12)c1ccccc1
O=S(=O)(c1c[nH]c2cccc(CCN3CCCC3)c12)c1ccccc1
O=S(=O)(c1c[nH]c2cccc(CCN3CCCCCC3)c12)c1ccccc1
CC1CCCCN1CCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CC1CCCN(CCc2cccc3[nH]cc(c23)S(=O)(=O)c2ccccc2)C1
CCN(C)CCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
CC(C)NCCCc1cccc2[nH]cc(c12)S(=O)(=O)c1ccccc1
O=S(=O)(c1c[nH]c2cccc(CCCN3CCCCC3)c12)c1ccccc1
O=S(=O)(c1c[nH]c2cccc(CCN3CCCCC3)c12)c1ccccc1
NCC1c2ccccc2Cc2ccccc12
CNCC1c2ccccc2Cc2ccccc12
CN(C)CC1c2ccccc2Cc2ccccc12
NCCC1c2ccccc2Cc2ccccc12
CNCCC1c2ccccc2Cc2ccccc12
CN(C)CCC1c2ccccc2Cc2ccccc12
NCCCC1c2ccccc2Cc2ccccc12
CNCCCC1c2ccccc2Cc2ccccc12
CN(C)CCCC1c2ccccc2Cc2ccccc12
NCC(c1ccccc1)c1ccccc1
CNCC(c1ccccc1)c1ccccc1
CN(C)CC(c1ccccc1)c1ccccc1
NCCC(c1ccccc1)c1ccccc1
CNCCC(c1ccccc1)c1ccccc1
CN(C)CCC(c1ccccc1)c1ccccc1
NCCCC(c1ccccc1)c1ccccc1
CNCCCC(c1ccccc1)c1ccccc1
CN(C)CCCC(c1ccccc1)c1ccccc1
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CN(C)CCCN1c2ccccc2Sc3c1cc(cc3)Cl
CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1 |c:8,15|
c1ccc2c(c1)NC(=O)N2CCCN3CCC(CC3)N4c5ccc(cc5NC4=O)Cl
OCCN1CCN(CC\C=C2/c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
CN1CCN(CC1)C1=Nc2cc(F)ccc2Cc2ccccc12 |t:8|
OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F
CN1CCN(CC1)C1=Nc2ccccc2Oc2ccc(Cl)cc12 |t:8|
CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1
CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1
Clc1cncc(n1)N1CCNCC1
c1ccc2c(c1)NC(=O)N2C3CCN(CC3)CCCC(c4ccc(cc4)F)c5ccc(cc5)F
C1CN(CCN1)c1ccc2ccccc2n1
CN1CCN(CC1)C1=Cc2cc(Cl)ccc2C(=CC#N)c2ccccc12 |w:17.19,t:8|
CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)c4c5ccc(cc5on4)F
[#6]-c1nc2sccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
c1ccc(cc1)N2CNC(=O)C23CCN(CC3)CCCC(=O)c4ccc(cc4)F
CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(N)(=O)=O
CN1CCN(CC1)C1=Nc2cscc2C(=CC#N)c2cscc12 |w:15.17,t:8|
CN1CCCC[C@H]1CCN2c3ccccc3Sc4c2cc(cc4)SC
CN(C)S(=O)(=O)c1ccc2Sc3ccccc3\C(=C\CCN3CCN(C)CC3)c2c1
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Oc1cc2CC[C@H]3NCc4ccccc4[C@H]3c2cc1O
CN1CCc2cc(c(O)cc2C(C1)c1cccc2CCOc12)[N+]([O-])=O
CN1CCc2cc(Cl)c(O)cc2C(C1)c1cccc2CCOc12
Oc1cc2CCNC[C@H](c3ccccc3)c2cc1O
CN(C)CCON=C(C=Cc1ccc(O)cc1)c1ccccc1F |w:6.5,8.7|
CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
c1(c(nc(c(n1)Cl)N)N)C(=O)NC(=N)N
NC(NC(=O)c1nc(Cl)c(N)nc1N)=NCc1ccccc1 |w:14.15|
NC(=N)NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1
CN(C)CCCC1(OCc2cc(ccc12)C#N)c1ccc(F)cc1
COc1ccc(OC[C@H]2CN(C)CC[C@@H]2c2ccccc2)cc1
CNCC[C@H](c1ccccc1)Oc2ccc(cc2)C(F)(F)F
CNCC[C@@H](Oc1ccc(cc1)C(F)(F)F)c1ccccc1
CNCC[C@@H](Oc1ccc(cc1)C(F)(F)F)c1ccccc1 |r|
C(Cc1c[nH]c2ccccc12)C1CCNCC1
c1cc(ccc1[C@@H]2CCNC[C@H]2COc3ccc4c(c3)OCO4)F
C1CN(CCN1)c1cccc2OCCOc12
CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1
c1ccc(cc1)CCCN2CCN(CC2)CCOC(c3ccc(cc3)F)c4ccc(cc4)F
CN(C)CCCN1c2ccccc2CCc3c1cccc3
CN1Cc2c(cccc2N)[C@@H](C1)c3ccccc3
CNc1cc(OC)c(cc1Cl)C(=O)NCCN(C)Cc1ccc(I)cc1
COc1ccc2C(CN(C)Cc2c1)c1ccc(Cl)c(Cl)c1
Fc1ccc(cc1)C(OCCN1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1
CN[C@H]1C[C@@H](c2ccccc12)c1ccc(Cl)c(Cl)c1 |r|
C(CN1CCN(C\C=C\c2ccccc2)CC1)OC(c1ccccc1)c1ccccc1
CN(C)C[C@@H]1C2CCC(CC2)[C@@H]1c1ccc(Cl)c(Cl)c1 |wU:11.13,4.3,TLB:12:11:6.7:10.9,THB:3:4:6.7:10.9,(4.42,-5.07,;3.76,-3.67,;2.22,-3.53,;4.65,-2.41,;4,-1.01,;5.68,-.26,;5.79,1.35,;5.19,2.75,;5.16,1.21,;6.61,.69,;7.15,-.75,;3.76,.53,;2.43,1.3,;1.1,.53,;-.23,1.3,;-.23,2.84,;-1.58,3.63,;1.1,3.61,;1.1,5.15,;2.43,2.84,)|
CNCCC(Oc1ccccc1OC)c1ccccc1
CNCCCC1(SC(C)(C)c2ccccc12)c1ccccc1
Cc1cccc2ccc(nc12)N1CCNCC1
NCCc1c[nH]c2ccc(O)cc12
CCCN(CCC)C1CCc2cccc(O)c2C1
CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc4cccc([C@@H]2C1)c34
CN(C)CCCSc1ccccc1NC(=O)\C=C\c1ccccc1
[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c2oc(cc(=O)c2c1-[#8])-c1ccccc1
CN(C)CCc1c[nH]c2c1cccc2
CN(C)CCc1c[nH]c2c1cc(cc2)OC
COC(CO)C(=O)OC(C)c1cccc2nc3c(cccc3nc12)C(O)=O
COC(CO)C(=O)O[C@@H](C)c1cccc2nc3c(cccc3nc12)C(O)=O |r|
CCc1cc(OC)c(CC(C)N)cc1OC
COc1cc(CC(C)N)c(OC)cc1I
COc1cc(CC(C)N)c(OC)cc1C
CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12 |THB:9:7:1:3.4|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C
Clc1cccc(c1)N1CCNCC1
COc1cc(cc(c1OC)OC)CCN
CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]2[C@H]1Cc1cn(C)c3cccc2c13
CN(C)CCc1c[nH]c2c1c(ccc2)O
CN(C)CCc1c[nH]c2c1c(ccc2)OP(=O)(O)O
COc1ccc2[nH]cc(C3=CCNCC3)c2c1 |t:9|
COc1cc(cc(OC)c1OC)C(C)=O
NCCc1c[nH]c2ccccc12
CCN1CCC[C@H]1CNC(=O)c1c(O)c(Br)ccc1OC
CCN1CCC[C@H]1CNC(=O)c1c(O)c(Br)cc(Br)c1OC
CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)ccc1OC
CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Br)c1OC
CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(CC)c1OC
CCc1cc(c(c(c1O)C(=O)NC[C@@H]2CCC[N@]2CC)OC)Cl
CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC
CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC
CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC
Cn1c2ncn(CCN3CCC(CC3)C(=O)c3ccc(F)cc3)c2c(=O)n(C)c1=O
[#7]\[#6](-[#7])=[#7]\[#7]=[#6]-c1c(Cl)cccc1Cl |w:5.5|
[#6]-c1nc2ccccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
CN(C)CCCN1c2ccccc2CCc3c1cc(cc3)Cl
COCCCCC(=NOCCN)c1ccc(Cl)cc1 |w:7.7|
CSc1ccc(cc1)[C@@H]1CN2CCC[C@@H]2c2ccccc12 |r|
CSc1ccc(cc1)[C@H]1CN2CCC[C@H]2c2ccccc12 |r|
CN[C@@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc12
Clc1cccc(c1)N1CCN(CCCn2nc3ccccn3c2=O)CC1
CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
CN1CCN2C(C1)c1ccccc1Cc1cccnc21
COc1cccc(C(O)C2CCN(CCn3c(=S)[nH]c4ccccc4c3=O)CC2)c1OC
COc1c(OCCF)cccc1C(O)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1
COc1c(OCCF)cccc1\C(=N\OCCN(C)C)C1CCN(CCc2ccc(F)cc2)CC1
COc1cccc(C(=O)C2CCN(CCn3c(=S)[nH]c4ccccc4c3=O)CC2)c1OC
COc1ccc2c(c1)c(c[nH]2)CCN
CN(C)CCc1c[nH]c2c1cc(cc2)O
CN1CCC[C@H]1c1cc(C)no1 |r|
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
CCCN(CCC)C1Cc2c[nH]c3ccc(C(C)=O)c(C1)c23
CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2Cc3cn(c4c3c(ccc4)C2=C1)C)C
Cn1ccc2cc(NC(=O)Nc3cccnc3)ccc12
COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r|
CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1
CN(C)CC\C=C1/c2ccccc2Sc2ccc(Cl)cc12
CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
CCc1c(C)[nH]c2CCC(CN3CCOCC3)C(=O)c12
c1cc(ccc1C(CCCN2CCC(CC2)(c3ccc(c(c3)C(F)(F)F)Cl)O)c4ccc(cc4)F)F
CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12 |t:8|
OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1
CN1CCN(CC1)CCCN2c3ccccc3Sc4c2cc(cc4)Cl
CC1CN(CCCn2c3ccccc3c3ccccc23)CC(C)N1
CN1CCN(CC1)CCCN2c3ccccc3Sc4c2cc(cc4)C(F)(F)F
Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)c3ccccc3C)C2=O)c1 |t:11|
CCCCN1CCC(COC(=O)c2cc(Cl)c(N)c3OCCOc23)CC1
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccccc2-[#6]=[#6]-c2ccccc-12 |c:16|
COc1cc(CC(C)N)c(OC)cc1Br
FC(F)(F)c1cccc(c1)N1CCNCC1
CCN1CCN(CC1)c1cc(-c2ccc(F)cc2)c2CCCCCCc2n1
CC(C)NC[C@@H](COc1ccccc1CC=C)O
COc1ccccc1N1CCN(CCN2C(=O)CC3(CCCC3)CC2=O)CC1
O=C1CC2(CCCC2)CC(=O)N1CCNCC1COc2ccccc2O1
COc1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1
C(CN1CCN(CC1)c1cccc2OCCOc12)C1Cc2ccccc12
C1C(Cc2ccccc12)N1CCN(CC1)c1cccc2OCCOc12
C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
CC(C)(C)NCC(O)COc1cccc2CCCSc12
COc1ccccc1N1CCN(C[C@@H](C(=O)NC(C)(C)C)c2ccccc2)CC1 |r|
Cc1nc[nH]c1CC1CCc2c(C)c3ccccc3n2C1=O
COc1ccc2n(cc(CCN)c2c1)C(C)C
CC(C)n1cc(CCN)c2cc(C)ccc12
CC(C)n1cc(CCN)c2ccccc12
NCCc1c[nH]c2ccc(Br)cc12
CC(C)n1cc(CCN)c2cc(Br)ccc12
Cc1ccc2c(c1)c(c[nH]2)CCN
CC(C)n1cc2CC3C(CC(CN3C)C(=O)NC3CCCCC3)c3cccc1c23
CC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:22|
CC(O)C(C)OC(=O)[C@@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1
CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)NC1CCCCC1
CC(C)Cn1cc2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)OC(C)C(C)O)c3cccc1c23
CC(C)n1cc2CC3C(CC(CN3C)C(=O)NC3CCCC3O)c3cccc1c23
CN1C[C@@H](C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N[C@@H]1CCC[C@@H]1O
COC1CCC(CC1)OC(=O)[C@@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1 |wU:13.24,11.11,wD:14.28,(3.85,8.25,;3.08,6.91,;3.85,5.58,;5.39,5.58,;6.16,4.25,;5.39,2.91,;3.85,2.91,;3.08,4.25,;6.16,1.58,;5.39,.24,;3.85,.24,;6.16,-1.09,;6.16,-2.63,;7.49,-3.4,;8.83,-2.63,;10.16,-3.4,;10.16,-4.94,;11.31,-5.97,;10.68,-7.38,;9.15,-7.22,;8,-8.25,;6.54,-7.77,;6.22,-6.26,;7.49,-4.94,;8.83,-5.71,;8.83,-1.09,;10.16,-.32,;7.49,-.32,)|
CC(O)C(C)OC(=O)C1CC2C(Cc3cn(C(C)C)c4cccc2c34)N(C)C1
CC(O)C(C)OC(=O)C1CC2C(Cc3c[nH]c4cccc2c34)N(C)C1
CCCN(CCC)CCc1cn(C(C)C)c2ccc(O)cc12
COC1CCC(CC1)OC(=O)C1CC2C(Cc3cn(C(C)C)c4cccc2c34)N(C)C1 |(1.08,-14.15,;-.25,-13.38,;-.25,-11.84,;1.09,-11.07,;1.09,-9.53,;-.24,-8.76,;-1.58,-9.53,;-1.58,-11.07,;-.24,-7.22,;-1.58,-6.45,;-2.91,-7.22,;-1.57,-4.91,;-.24,-4.14,;-.24,-2.6,;-1.57,-1.83,;-1.57,-.29,;-.24,.48,;.32,2.08,;1.86,2.08,;2.75,3.34,;2.1,4.74,;4.28,3.2,;2.43,.48,;3.76,-.29,;3.76,-1.83,;2.43,-2.6,;1.09,-1.83,;1.09,-.29,;-2.9,-2.6,;-4.24,-1.83,;-2.91,-4.14,)|
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)C(=O)NC1CCCCC1
CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1 |c:8,15|
OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:13|
CN(C)CCC=C1c2ccccc2C=Nc2ccc(Cl)cc12 |w:5.4,c:14|
CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1
COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CCNS(C)(=O)=O)CC1
NC(SCCCc1cnc[nH]1)=NCCc1ccc(I)cc1 |w:11.12|
S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
FC(F)(F)c1ccc(cc1)N1CCN(CCn2c3ccccc3[nH]c2=O)CC1
c1cnc(nc1)N2CCN(CC2)CCCCN3C(=O)CC4(CCCC4)CC3=O
COC1CN(CCCOc2ccc(F)cc2)CCC1NC(=O)c1cc(Cl)c(N)cc1OC
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c4c(cccc4[nH]c3Br)C2=C1)C
OC(C1CCN(CCc2ccccc2)CC1)c1ccccc1
CC(=O)NCCc1c[nH]c2c1cc(cc2)OC
NC(=O)C1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)N1CCCCC1
Cc1nc2ccccn2c(=O)c1CCN1CCC(CC1)C(=O)c1ccc(F)cc1
CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12
Cc1cc(NC(=O)Nc2ccc3n(C)ccc3c2)sn1
COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1N1CCN(C)CC1
Cn1ccc2cc3N(CCc3cc12)C(=O)Nc1cccnc1
CN1CC2C(C1)c1cc(Cl)ccc1Oc1ccccc21
[#7]\[#6](-[#7])=[#7]\[#7]=[#6](-[#6]-1-[#6]-[#6]-[#6](Cl)-[#16]-1)-c1ccccc1 |w:4.3|
[#6]-[#6]-[#6]-c1c(-[#6]-[#8]-c2ccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])cc2)ccc(-[#6](-[#6])=O)c1-[#8] |w:11.10|
[#6]-[#6]-[#6]-c1c(-[#6]-[#8]-c2ccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])c(-[#8]-[#6])c2)ccc(-[#6](=O)-[#6]-[#6])c1-[#8] |w:11.10|
[#6]-[#6]-[#6]-c1cc(ccc1-[#8]-c1cccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])c1)C([#6])([#6])[#6] |w:15.15|
[#6]-[#6]-[#6]-c1c(-[#6]-[#8]-c2ccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])cc2)ccc(-[#6](=O)-[#6]-[#6])c1-[#8] |w:11.10|
[#6]-c1ccc(-[#6])c(-[#6]-[#8]-c2ccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])cc2)c1 |w:13.12|
[#7]\[#6](-[#7])=[#7]\[#7]=[#6]-c1cccc(-[#8]-[#6]-c2ccc(cc2)-[#6](=O)-c2ccccc2)c1 |w:5.5|
[#6]-[#7](-[#6])-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
Clc1ccc2Oc3ccccc3N=C(N3CCNCC3)c2c1 |t:13|
CNCCCN1c2ccccc2CCc3c1cccc3
CN(C)CC/C=C\1/c2ccccc2COc3c1cccc3
CN(C)CCCn1c2CCCCCCc2c2ccccc12
CNCCCC12CCC(c3ccccc13)c1ccccc21 |TLB:10:9:6.7:20.15,16:15:6.7:14.9,THB:13:14:6.7:20.15,19:20:6.7:14.9|
c1ccc(cc1)[C@H](CCN)Oc2ccc(cc2)C(F)(F)F
[#6]-[#7]-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
CN(C)C\C=C(\c1ccc(Br)cc1)c1cccnc1
C(Oc1cccnc1)[C@@H]1CCN1 |r|
NC(CNc1ccccc1)=NCCCOc1ccccc1Cl |w:10.11|
Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
c1ccc2c(c1)c(ns2)N3CCN(CC3)CCc4cc5c(cc4Cl)NC(=O)C5
NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1
CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC
COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O
CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Fc1ccc(cc1)N1CCN(CCC2OCCc3ccccc23)CC1
CCCN(CCC)[C@H]1CCc2c(F)ccc(O)c2C1
Clc1cc2OCCOc2c(c1)N1CCN(CCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
CC(C)NCC(O)COc1cccc2[nH]ccc12
COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1Cl
OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
CCCN(CCC)CCc1c[nH]c2ccc(cc12)C(N)=O
C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)Cc4ccccc4)NC(=O)[C@H]5CN([C@@H]6Cc7c[nH]c8c7c(ccc8)C6=C5)C
Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12
[H][C@@]12Cc3c[nH]c4cccc(C1=C[C@H](CN2C)NC(=O)N(CC)CC)c34 |r,c:12|
CSc1ccc2Sc3ccccc3CC(N3CCN(C)CC3)c2c1
Cc1cc(c(c(c1CC2=NCCN2)C)O)C(C)(C)C
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
CN1CC[C@@H]2CN3CCc4cccc([C@@H]2C1)c34 |r|
CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1
COc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2 |(27.19,-33.96,;28.52,-34.73,;28.53,-36.27,;27.2,-37.04,;27.2,-38.58,;25.86,-39.35,;28.53,-39.36,;28.53,-40.89,;29.87,-38.58,;29.86,-37.03,;31.19,-36.26,;31.19,-34.72,;32.53,-37.02,;33.86,-36.25,;35.2,-37.02,;36.52,-36.25,;36.52,-34.71,;35.19,-33.94,;33.85,-34.71,;34.61,-36.04,;35.74,-34.91,)|
OC(CN1CCN(CC1)c1cccc(Cl)c1)C(c1ccccc1)c1ccccc1
COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1OCCN(C)C
NC(=O)c1ccc(F)c2OCC(Cc12)N(C1CCC1)C1CCC1
CN(C)C1CCc2[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc3c2C1
CC(O)c1nn(CCCN2CCN(CC2)c2ccc(Cl)cc2)c(=O)n1CCOc1ccccc1
CCc1nn(CCCN2CCN(CC2)c2cccc(Cl)c2)c(=O)n1CCOc1ccccc1
Clc1cccc(c1)N1CCN(CCCn2[nH]c(=O)n(CCOc3ccccc3)c2=O)CC1
COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2[C@@]3(C)CCC(C3)C2(C)C)cc1 |r,TLB:21:22:28:26.25|
C[C@H](CCN1CCC(C)CC1)N(C)S(=O)(=O)c1cccc(C)c1
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Oc2ccccc12 |t:8|
COc1cccc([C@H](O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC |r|
O=C1C2CCCCC2C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
O=C1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)N1C[C@@H]1CCCC[C@H]1CN1CCN(CC1)c1nsc2ccccc12
Cc1[nH]c2ccc(O)cc2c1CCN
C[C@@H](Cc1ccccc1)N
CN1CCc2cccc-3c2[C@H]1Cc4c3c(c(cc4)O)O
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5Cc6c7c(cccc7[nH]c6Br)C5=C4)C)O
c1ccc2c(c1)C=Cc3ccccc3N2C(=O)N
CN1CCN(CC1)c1nc2cc(ccc2n2cccc12)C(F)(F)F
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)c1ccccc1)N2C |@@:20|
C[C@H](Cc1ccccc1)N(C)CC#C |r|
CN1CC(CC2C1Cc1c[nH]c3cccc2c13)C(=O)N[C@]1(C)O[C@@]2(O)C3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O
c1cc(c(cc1CCN)O)O
OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
CC[C@@H]1CC2C[C@H]3C1N(C2)CCc1c3[nH]c2ccc(OC)cc12 |TLB:3:4:7:13.12.11.10,THB:13:6:8.9:2.3,1:2:8.9:6.5,10:8:6.5:2.3|
C1CN=C(N1)C1COc2ccccc2O1 |c:2|
NC(Cc1ccc(O)c(O)c1)C(O)=O
CC(N)Cc1ccc2OCOc2c1
CN1C2CCC1CC(C2)OC(=O)c1cc(Cl)cc(Cl)c1 |THB:9:7:1:3.4|
C[C@@H](Cc1ccc2c(c1)OCO2)NC
C[C@@H](Cc1ccccc1)NC
COC(=O)[C@H]([C@@H]1CCCCN1)c1ccccc1
Cc1nccn1CC2CCc3c(c4ccccc4n3C)C2=O
Cc1ccc(cc1)N(CC1=NCCN1)c1cccc(O)c1 |t:10|
CCCN1CCCC(C1)c1cccc(O)c1
CC(C)NC[C@@H](COc1cccc2c1cccc2)O
CCCN1CCC[C@@H]2Cc3[nH]ncc3C[C@@H]12 |r|
COc1ccc2c(c1)[nH]c3c2CCN4[C@@H]3C[C@H]5[C@@H](C4)C[C@H]([C@@H]([C@H]5C(=O)OC)OC)OC(=O)c6cc(c(c(c6)OC)OC)OC
Oc1cc2CCN(CC=C)CC(c3ccccc3)c2cc1O
Oc1cc2[C@H](C[NH2+]CCc2c(Cl)c1O)c1ccccc1
Oc1cc2C(CN(CC=C)CCc2c(Cl)c1O)c1ccccc1
c1ccc(cc1)[C@@H]2C[C@H]2N
CNc1cc(OC)c(cc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C
CN1CCC2(COc3cc4CCN(C(=O)c5ccc(cc5)-c5ccc(cc5C)-c5noc(C)n5)c4cc23)CC1
CCCCCCOc1c(nsn1)C2=CCCN(C2)C
COc1ccc(OC)c(CC(C)N)c1
COc1cc(C(C)=O)c(OC)cc1CC(C)N
COc1cc(Cc2ccccc2)c(OC)cc1CC(C)N
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO |r,t:8|
COc1cc(C#N)c(OC)cc1CC(C)N
COc1cc(CC(C)N)c(OC)cc1F
CCCCCCc1cc(OC)c(CC(C)N)cc1OC
COc1cc(c(OC)cc1CC(C)N)[N+]([O-])=O
CCCc1cc(OC)c(CC(C)N)cc1OC
COc1cc(c(OC)cc1CC(C)N)C(C)(C)C
COc1cc(CC(C)N(C)C)c(OC)cc1Br
COCCOCCl
COc1cc(CC(C)[N+](C)(C)C)c(OC)cc1Br
COc1cc(CC(C)N)cc(OC)c1OC
CN(C)CCC=C1c2ccccc2CSc2ccccc12 |w:5.4|
COCCCC/C(=N\OCCN)/c1ccc(cc1)C(F)(F)F
CN(CCCN1c2ccccc2CCc2ccccc12)CC(=O)c1ccc(Cl)cc1
CC(C)c1cc(nc(N)n1)-c1ccc(F)c2ccccc12
c1cc2c(cc1C(=O)N)c(c[nH]2)CCN
Cn1cc(CCN)c2cc(O)ccc12
CCN(CC)C(=O)N[C@@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C
CCN(CC)C(=O)N[C@@H]1CN(C)[C@H]2Cc3c[nH]c4cccc(C2=C1)c34 |r,c:23|
C[C@H](N)Cc1cccc(c1)C(F)(F)F
FC(F)(F)c1ccc(nc1Cl)N1CCNCC1
COc1ccc2CCCc2c1[C@@H]1CCNC1
CC(N)Cn1ccc2cc(F)c(Cl)cc12
Fc1cccc2OC3CNCC3Oc12
CCN[C@H](C)Cc1cccc(c1)C(F)(F)F |r|
C[C@@H](N)Cc1cccc(c1)C(F)(F)F |r|
CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1
CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(Br)c2)CC1
CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc3ccccc23)CC1
CC1CCN(CC[C@H]2CCCCC2S(=O)(=O)c2cccc3ccccc23)CC1
CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(C)c2)CC1
CC1CCN(CCC2CCCCC2S(=O)(=O)c2cccc3ccccc23)CC1
CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r|
CCCN(CCC)C1CCc2cc(CS(=O)(=O)c3ccc(OC)cc3)ccc2C1
OC1(CCN(Cc2c[nH]c3ccccc23)CC1)c1ccc(Cl)cc1
O=C(NCCCCN1C[C@@H]2COc3ccc(cc3[C@H]2C1)C#N)c1ccc(cc1)-c1ccccc1 |r|
O=C(NC1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |wD:6.6,(-3.87,-1.76,;-3.86,-3.3,;-2.52,-4.08,;-1.18,-3.3,;-1.19,-1.76,;.15,-.99,;1.48,-1.76,;2.83,-.99,;4.16,-1.76,;5.49,-.99,;5.49,.54,;6.84,1.31,;8.17,.53,;9.5,1.3,;10.83,.53,;10.81,-1.01,;9.48,-1.78,;8.16,-1.01,;6.84,-1.78,;12.17,1.29,;13.5,2.07,;1.48,-3.3,;.15,-4.08,;-5.19,-4.09,;-5.19,-5.64,;-6.54,-6.41,;-7.87,-5.64,;-7.87,-4.09,;-9.19,-3.33,;-9.2,-1.81,;-7.87,-1.03,;-6.54,-1.78,;-6.54,-3.33,)|
Nc1ncnc2nc(cc(-c3cccc(Br)c3)c12)-c1ccc(nc1)N1CCOCC1
CCNC(C)Cc1cccc(c1)C(F)(F)F
CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C
CC(C)(N)Cc1ccccc1
COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(N)c2CCOc12
CCOc1ccccc1O[C@@H](c2ccccc2)[C@@H]3CNCCO3
COc1ccc2CC(CN(C)C)(c2c1)C1(O)CCCCC1
CC(CF)NCC(O)COc1cccc2[nH]c3ccccc3c12
CCCN(C(C)C)[C@H]1COc2cccc(C(=O)NC(C)C)c2C1
CCCN(C(C)C)[C@H]1COc2cccc(C(N)=O)c2C1
CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3
Nc1c(Cl)cc(-c2nn(C3CCN(CCc4ccccc4)CC3)c(=O)o2)c2OCCOc12
O=C1Nc2cccc3ccc(CCCCN4CCC(=CC4)c4ccccc4)c1c23 |c:18|
COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r|
CCNC(=O)N(CCCN(C)C)C(=O)C1CC2C(Cc3c[nH]c4cccc2c34)N(CC=C)C1
CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13
C(N1CCN(CC1)c1ncccn1)c1ccc2OCOc2c1
CCCNC1CCc2nc(N)sc2C1
CCCN1CCC[C@@H]2Cc3nc(N)ncc3C[C@@H]12
CCCN(CCC)CCc1cccc2NC(=O)Cc12
Oc1ccc2[nH]cc(CCCCN3CCC(=CC3)c3ccccc3)c2c1 |c:15|
Nc1nc2CCN(CC=C)CCc2s1
CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1
C[NH+](C)C1CCc2cc(O)c(O)cc2C1
CNCCC(Oc1ccccc1C)c1ccccc1
CC(CN(C)C)CN1c2ccccc2Sc2ccc(cc12)C#N
c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=O)CC4
CN(C)S(=O)(=O)c1ccc2Sc3ccccc3C(=CCCN3CCN(C)CC3)c2c1 |w:18.19|
NC(CSSCC(N)C(O)=O)C(O)=O
N[C@H](CCS(O)(=O)=O)C(O)=O |r|
N[C@H](CCS(O)=O)C(O)=O |r|
N[C@@H]1CCSC1=O |r|
CSCC[C@H](C(=O)O)N
C(CS(=O)(=O)O)[C@@H](C(=O)O)N
C(CS)[C@@H](C(=O)O)N
C([C@H](C(=O)O)N)S(=O)(=O)O
C([C@@H](C(=O)O)N)S
NC(CS(O)=O)C(O)=O
C(CS(=O)(=O)O)[C@@H](C(=O)O)N
N[C@@H](CCS(O)=O)C(O)=O |r|
N[C@H]1CCSC1=O |r|
CC(=O)NCCc1cccc2c1cc(cc2)OC
C[C@@H](Cc1ccc2c(c1)OCO2)NC
Cc1cccc(c1)[C@@H]2CN(CCc3c2cc(c(c3Cl)O)O)C
CN1CCc2c(Br)c(O)c(O)cc2[C@@H](C1)c1cccc(C)c1 |r|
Cc1cccc(c1)C1CN(CC=C)CCc2c(Br)c(O)c(O)cc12
Cc1cccc(c1)C1CNCCc2c(Br)c(O)c(O)cc12
CN1CCc2c(Cl)c(O)c(O)cc2C(C1)c1ccc(C)cc1
CN1CCc2c(Cl)c(O)c(O)cc2C(C1)c1ccccc1C
Cc1cccc(c1)C1CNCCc2c(Cl)c(O)c(O)cc12
Cc1cccc(c1)C1CN(CC=C)CCc2c(Cl)c(O)c(O)cc12
CN1CCc2c(cc(O)c(O)c2Br)[C@@H](C1)c1cccc(c1)C(F)(F)F |r|
CN1CCc2c(Br)c(O)c(O)cc2C(C1)c1ccc(C)cc1
Cc1ccc(cc1)C1CN(CC=C)CCc2c(Br)c(O)c(O)cc12
CN1CCc2c(Br)c(O)c(O)cc2C(C1)c1ccccc1C
Cc1ccccc1C1CN(CC=C)CCc2c(Br)c(O)c(O)cc12
Cc1ccccc1C1CNCCc2c(Br)c(O)c(O)cc12
Oc1cc2C(CN(CC=C)CCc2c(Br)c1O)c1ccccc1C(F)(F)F
Oc1cc2[C@@H](CNCCc2c(Br)c1O)c1cccc(c1)C(F)(F)F |r|
CN1CCc2cc(Cl)c(O)cc2C(C1)c1ccccc1
Oc1cc2CCNCC(c3ccccc3)c2cc1O
Oc1cc2C(CNCCc2c(Cl)c1O)c1ccccc1
Cc1cccc(c1)[C@H]2CN(CCc3c2cc(c(c3Cl)O)O)C
NCCc1ccccc1
C1CC2(CN1)c1ccccc1Cc1ccccc21
CCc1cc2c(ccc3cnn(CC(C)N)c23)o1
CCCN1CCOC2C1CCc1ccc(cc21)C(N)=O
CCc1c(nn(c1-c1ccc(Br)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Fc1ccc(OCCCN2CCC3(CC2)N(CNC3=O)c2ccccc2)cc1
CC(C)CC(N)C1(CCC1)c1ccc(Cl)cc1
CN1CC(C=C2C1Cc1c[nH]c3cccc2c13)C(=O)NC1(C)OC2(O)C3CCCN3C(=O)C(Cc3ccccc3)N2C1=O |c:4|
CCN(CC)C(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:22|
COc1cccc(C(O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
CN(C)S(=O)(=O)NC1CC2C(Cc3cn(C)c4cccc2c34)N(C)C1
CN1CC(CNC(=O)OCc2ccccc2)CC2C1Cc1cn(C)c3cccc2c13
CCC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:23|
CN1CCN2C(C1)c1ccccc1Cc1ccccc21
COc1ccc2CCCc2c1O[C@H]1CCNC1
CCCN1CCCC2Cc3[nH]ncc3CC12
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
CC(C)CC(N(C)C)C1(CCC1)c1ccc(Cl)cc1
C[C@H](N)CN1CCc2ccc(Br)cc12
CC(C)C(=O)N(C1CC(C)N(C(=O)c2ccccc2)c2ccccc12)c1ccccc1
CCC(=O)N1C(C)CC(N(C(C)=O)c2ccccc2)c2ccccc12
CC1CC(N(C(=O)C2CC2)c2ccccc2)c2ccccc2N1C(=O)c1ccccc1
ONC=Nc1ccc(N2CCOCC2)c(Cl)c1 |w:3.3|
NC(=O)c1cccc(c1)-c1cccc(OC(=O)NC2CCCCC2)c1
COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1
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CCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nccc3occc23)CC1 |r,wU:5.4,wD:8.8,(9.62,1.85,;8.85,.52,;7.31,.52,;6.54,-.82,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.92,1.85,;.38,1.85,;-.39,.52,;-1.93,.52,;-2.7,-.82,;-4.24,-.82,;-5.01,.52,;-4.24,1.85,;-2.7,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.62,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
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OCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nccc3occc23)CC1 |r,wU:5.4,wD:8.8,(9.62,1.85,;8.85,.52,;7.31,.52,;6.54,-.82,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.92,1.85,;.38,1.85,;-.39,.52,;-1.93,.52,;-2.7,-.82,;-4.24,-.82,;-5.01,.52,;-4.24,1.85,;-2.7,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.62,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
COCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nccc3occc23)CC1 |r,wU:6.5,wD:9.9,(10.4,-.82,;8.86,-.82,;8.09,.52,;6.55,.52,;5.78,-.82,;5.78,1.85,;4.24,1.85,;3.46,.52,;1.93,.52,;1.15,1.85,;-.39,1.85,;-1.15,.52,;-2.7,.52,;-3.46,-.82,;-5,-.82,;-5.78,.52,;-5,1.85,;-3.46,1.85,;-7.32,.52,;-8.09,1.85,;-9.63,1.85,;-10.4,.52,;-9.63,-.82,;-10.1,-2.28,;-8.86,-3.19,;-7.61,-2.28,;-8.09,-.82,;1.93,3.19,;3.46,3.19,)|
CO[C@H]1CC[C@H](CC(=O)N[C@H]2CC[C@H](CCN3CCN(CC3)c3nccc4occc34)CC2)CC1 |r,wU:10.9,5.5,wD:13.13,2.1,(11.55,-2.82,;10.01,-2.82,;9.24,-1.48,;10.01,-.15,;9.24,1.18,;7.7,1.18,;6.93,2.52,;5.39,2.52,;4.62,3.85,;4.62,1.18,;3.08,1.18,;2.31,-.15,;.77,-.15,;,1.18,;-1.54,1.18,;-2.31,-.15,;-3.85,-.15,;-4.62,-1.48,;-6.16,-1.48,;-6.93,-.15,;-6.16,1.18,;-4.62,1.18,;-8.47,-.15,;-9.24,1.18,;-10.78,1.18,;-11.55,-.15,;-10.78,-1.48,;-11.26,-2.95,;-10.01,-3.85,;-8.76,-2.95,;-9.24,-1.48,;.77,2.52,;2.31,2.52,;6.93,-.15,;7.7,-1.48,)|
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CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2cccc3OCOc23)CC1 |r,wU:6.5,wD:9.9,(9.63,1.85,;8.85,.52,;9.63,-.82,;7.31,.52,;6.54,-.82,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.93,1.85,;.38,1.85,;-.38,.52,;-1.93,.52,;-2.69,-.82,;-4.23,-.82,;-5,.52,;-4.23,1.85,;-2.69,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.63,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
FCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2cccc3OCOc23)CC1 |r,wU:5.4,wD:8.8,(9.63,-.82,;8.85,.52,;7.31,.52,;6.54,-.82,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.93,1.85,;.38,1.85,;-.38,.52,;-1.93,.52,;-2.69,-.82,;-4.23,-.82,;-5,.52,;-4.23,1.85,;-2.69,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.63,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
Clc1ccc(NC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3cccc4OCOc34)CC2)cc1 |r,wU:9.8,wD:12.12,(10.78,4.52,;10.01,3.19,;10.78,1.85,;10.01,.52,;8.47,.52,;7.7,-.82,;6.16,-.82,;5.39,-2.15,;5.39,.52,;3.85,.52,;3.08,-.82,;1.54,-.82,;.77,.52,;-.77,.52,;-1.54,-.82,;-3.08,-.82,;-3.85,-2.15,;-5.39,-2.15,;-6.16,-.82,;-5.39,.52,;-3.85,.52,;-7.7,-.82,;-8.47,.52,;-10.01,.52,;-10.78,-.82,;-10.01,-2.15,;-10.49,-3.61,;-9.24,-4.52,;-7.99,-3.61,;-8.47,-2.15,;1.54,1.85,;3.08,1.85,;7.7,1.85,;8.47,3.19,)|
CN(C)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2cccc3OCOc23)CC1 |r,wU:7.6,wD:10.10,(7.31,-2.15,;8.08,-.82,;9.63,-.82,;7.31,.52,;8.65,1.29,;5.98,-.25,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.93,1.85,;.38,1.85,;-.38,.52,;-1.93,.52,;-2.69,-.82,;-4.23,-.82,;-5,.52,;-4.23,1.85,;-2.69,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.63,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
O=S(=O)(N[C@H]1CC[C@H](CCN2CCC(CC2)c2cccc3OCOc23)CC1)N1CCOCC1 |r,wU:4.3,wD:7.7,(8.26,1.44,;6.93,.67,;5.6,-.1,;6.16,2,;4.62,2,;3.85,.67,;2.31,.67,;1.54,2,;,2,;-.77,.67,;-2.31,.67,;-3.08,-.67,;-4.62,-.67,;-5.39,.67,;-4.62,2,;-3.08,2,;-6.93,.67,;-7.7,2,;-9.24,2,;-10.01,.67,;-9.24,-.67,;-9.72,-2.13,;-8.47,-3.04,;-7.22,-2.13,;-7.7,-.67,;2.31,3.33,;3.85,3.33,;7.7,-.67,;9.24,-.67,;10.01,-2,;9.24,-3.33,;7.7,-3.33,;6.93,-2,)|
CN1CCN(CC1)C2=Nc3cc(ccc3Nc4c2cccc4)Cl
Clc1ccc(CN2CCN(CC2)C(=O)c2ccco2)cc1
COc1cccc(OCC(O)CN2CCN(CC2)c2ccccn2)c1
Clc1ccc(CN2CCN(CC2)c2ncccn2)cc1Cl
OC(COc1ccc2cc(Br)ccc2c1)CN1CCN(CC1)c1ccccn1
[H][C@@]12CCCN1C(=O)[C@H](CC(C)C)N1C(=O)[C@](NC(=O)[C@H]3CN(C)C4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]21O)C(C)C
COc1cccc(c1)-n1cc(CNCc2cn(C)nc2-c2ccccc2F)cn1
CN(c1ccc(cc1)C(=O)N1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(CN2CCN(CC2)c2ncccn2)c1
Cc1cccc(CN2CCN(CC2)c2ncccn2)c1
COc1ccc(CC2(CO)CCN(Cc3cc4ccccc4o3)CC2)cc1
C(Oc1ccc(CN2CCN(CC2)c2ccccn2)cc1)c1ccccc1
CCOC(=O)C1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1
CC(=O)N1CCc2cc(ccc12)C(=O)CN1CCN(CC1)c1cccc(Cl)c1
COc1ccc(CN2CCN(CC2)C(=O)c2ccco2)cc1OCc1ccccc1
Clc1ccccc1CN1CCN(CC1)c1ccccc1
Clc1ccccc1CN1CCN(CC1)c1ncccn1
COc1ccc(CN2CCN(CC2)c2ncccn2)c(OC)c1
CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13 |r|
C(N1CCN(CC1)c1ncccn1)c1ccccc1
CCn1c2ccccc2c(SCC(=O)NCCCN2CCN(CC2)c2ccccc2F)cc1=O
Brc1ccc(CN2CCN(CC2)c2ccccn2)s1
[#6]C1([#6])[#6](\[#6]=[#6](\Cl)Cl)-[#6]1-[#6](=O)-[#7]-1-[#6]-[#6]-[#7](-[#6]-c2ccccc2)-[#6]-[#6]-1
OCC1(Cc2cccc(c2)C(F)(F)F)CCN(Cc2cc3ccccc3o2)CC1
Cn1cc(nc1-c1ccc(OCC(O)CNCCOc2ccc(O)c(c2)C(N)=O)cc1)C(F)(F)F
Oc1ccc(CN2CCN(CC2)c2ncccn2)cc1
Cc1ccc(CN2CCN(CC2)c2ncccn2)o1
CC(=O)N1CCC(CC1)N1CCN(CC1)c1ccccc1F
c1cc(c(c2c1[C@@H](O[C@@H](C2)C34CC5CC(C3)CC(C5)C4)CN)O)O
Clc1ccc(CN2CCN(CC2)c2ncccn2)cc1
CCOc1ccc(NC(=O)CCN2CCN(CC2)c2ccccc2F)cc1
CCc1ccc(CN2CCN(CC2)C(=O)c2ccco2)cc1
NC1CCc2cc(O)c(O)cc2C1
CC1CC(C)CN(CCOc2cccc(Cl)c2Cl)C1
CCOC(=O)N1CCN(Cc2ccc(OCC(O)CN3CCCCC3)cc2)CC1
C[C@H](CCc1ccc(cc1)O)NCCc2ccc(c(c2)O)O
Cc1ccc(CN2CCN(CC2)c2ncccn2)c(C)c1
C(N1CCN(CC1)c1ccccn1)c1ccsc1
COc1ccc(CN2CCN(CC2)c2ccccn2)c(OC)c1
COc1ccc(CN2CCN(CC2)c2ncccn2)c(C)c1C
CCOc1cc(CN2CCN(CC2)C(=O)c2ccco2)ccc1OC
O=C(CN1CCN(CC1)c1ccccn1)Nc1ccc(Oc2ccccc2)cc1
c1ccc2c(c1)c(c3c(n2)CCCC3)N
COC(=O)C1C(NC(=O)N=C1Cn1cnc2ccccc12)c1cc(C)ccc1C |c:9|
COc1cc(CN2CCN(CC2)c2ncccn2)cc(OC)c1
Cc1ccc(CN2CCN(CC2)c2ccccn2)s1
Cc1cccc(CN2CCN(CC2)c2ccccn2)c1
COc1cc(Br)cc(CN2CCN(CC2)c2ncccn2)c1O
Fc1cccc(CN2CCN(CC2)c2ncccn2)c1
COc1ccccc1C(=O)NCCN1CCN(CC1)c1ccccc1
CCCN1CCC[C@@H](C1)c1cccc(O)c1
Cc1ccsc1CN1CCN(CC1)c1ccccn1
CC(COc1ccccc1)N1CCC(CO)(Cc2ccccc2)CC1
Fc1ccccc1CN1CCN(CC1)c1ncccn1
Brc1cccc(CN2CCN(CC2)c2ncccn2)c1
Cn1nccc1-c1cc(NC(=O)C(=O)c2ccc(F)cc2)ccc1OCCN
Cn1ncc(Cl)c1-c1cc(NC(=O)C2CCC(CC2)C(F)(F)F)ccc1OCCN |(7.64,.46,;6.87,-.87,;7.35,-2.34,;6.1,-3.24,;4.86,-2.34,;3.53,-3.11,;5.33,-.87,;4,-.1,;2.67,-.87,;1.33,-.1,;,-.87,;-1.33,-.1,;-1.33,1.44,;-2.67,-.87,;-4,-.1,;-5.33,-.87,;-5.33,-2.41,;-4,-3.18,;-2.67,-2.41,;-6.67,-3.18,;-8,-3.95,;-7.44,-1.85,;-5.9,-4.52,;1.33,1.44,;2.67,2.21,;4,1.44,;5.33,2.21,;5.33,3.75,;6.67,4.52,;8,3.75,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)c2ccc(F)c(c2)C(F)(F)F)ccc1OCCN |(7.72,.46,;6.95,-.88,;7.85,-2.12,;6.95,-3.37,;5.48,-2.89,;4.15,-3.66,;5.48,-1.35,;4.15,-.58,;2.82,-1.35,;1.48,-.58,;.15,-1.35,;-1.18,-.58,;-1.18,.96,;-2.52,-1.35,;-2.52,-2.89,;-3.85,-3.66,;-5.19,-2.89,;-6.52,-3.66,;-5.19,-1.35,;-3.85,-.58,;-6.52,-.58,;-7.85,.19,;-5.75,.75,;-7.29,-1.92,;1.48,.96,;2.82,1.73,;4.15,.96,;5.48,1.73,;5.48,3.27,;6.97,3.66,;7.74,2.33,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)C(=O)c2cc(Br)cs2)ccc1OCCN |(7.61,.31,;6.84,-1.03,;7.75,-2.27,;6.84,-3.52,;5.38,-3.04,;4.29,-4.13,;5.38,-1.5,;4.05,-.73,;2.71,-1.5,;1.38,-.73,;.05,-1.5,;-1.29,-.73,;-1.29,.81,;-2.62,-1.5,;-2.62,-3.04,;-3.96,-.73,;-3.88,.81,;-5.31,1.36,;-5.71,2.85,;-6.28,.16,;-5.44,-1.13,;1.38,.81,;2.71,1.58,;4.05,.81,;5.38,1.58,;5.38,3.12,;6.87,3.52,;7.96,2.43,)|
Cn1nccc1-c1cc(NC(=O)c2ccno2)ccc1OCCN
COCCNCCOc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1-c1c(Cl)cnn1C |(-2.52,3.08,;-1.18,3.85,;.15,3.08,;1.48,3.85,;2.82,3.08,;4.15,3.85,;5.48,3.08,;5.48,1.54,;4.15,.77,;2.82,1.54,;1.48,.77,;1.48,-.77,;.15,-1.54,;-1.18,-.77,;-1.18,.77,;-2.52,-1.54,;-2.52,-3.08,;-3.85,-3.85,;-5.19,-3.08,;-5.19,-1.54,;-3.85,-.77,;-6.52,-.77,;-5.75,.56,;-7.29,-2.1,;-7.85,,;2.82,-1.54,;4.15,-.77,;5.48,-1.54,;5.48,-3.08,;4.15,-3.85,;6.95,-3.56,;7.85,-2.31,;6.95,-1.06,;7.72,.27,)|
COc1cccc(c1)C(=O)Nc1ccc(OCCO)c(c1)-c1c(Cl)cnn1C |(-6.67,1.05,;-6.67,-.49,;-5.33,-1.26,;-5.33,-2.8,;-4,-3.57,;-2.67,-2.8,;-2.67,-1.26,;-4,-.49,;-1.33,-.49,;-1.33,1.05,;,-1.26,;1.33,-.49,;1.33,1.05,;2.67,1.82,;4,1.05,;5.33,1.82,;5.33,3.36,;6.67,4.13,;8,3.36,;4,-.49,;2.67,-1.26,;5.33,-1.26,;5.33,-2.8,;4,-3.57,;6.8,-3.27,;7.7,-2.03,;6.8,-.78,;7.57,.55,)|
COCCOc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1-c1ccnn1C
COCCNC(=O)COc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1-c1c(Cl)cnn1C |(-2.52,3.08,;-1.18,3.85,;.15,3.08,;1.48,3.85,;2.82,3.08,;4.15,3.85,;4.15,5.39,;5.48,3.08,;5.48,1.54,;4.15,.77,;2.82,1.54,;1.48,.77,;1.48,-.77,;.15,-1.54,;-1.18,-.77,;-1.18,.77,;-2.52,-1.54,;-2.52,-3.08,;-3.85,-3.85,;-5.19,-3.08,;-5.19,-1.54,;-3.85,-.77,;-6.52,-.77,;-5.75,.56,;-7.29,-2.1,;-7.85,,;2.82,-1.54,;4.15,-.77,;5.48,-1.54,;5.48,-3.08,;4.15,-3.85,;6.95,-3.56,;7.85,-2.31,;6.95,-1.06,;7.72,.27,)|
CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:4.3,wD:7.7,(9.24,.52,;7.7,.52,;6.93,-.82,;6.93,1.85,;5.39,1.85,;4.62,.52,;3.08,.52,;2.31,1.85,;.77,1.85,;,.52,;-1.54,.52,;-2.31,-.82,;-3.85,-.82,;-4.62,.52,;-3.85,1.85,;-2.31,1.85,;-6.16,.52,;-6.93,1.85,;-8.47,1.85,;-9.24,.52,;-8.47,-.82,;-8.95,-2.28,;-7.7,-3.19,;-6.45,-2.28,;-6.93,-.82,;3.08,3.19,;4.62,3.19,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:7.6,wD:10.10,(10.78,-2.15,;10.01,-.82,;8.47,-.82,;7.7,.52,;6.16,.52,;5.39,-.82,;5.39,1.85,;3.85,1.85,;3.08,.52,;1.54,.52,;.77,1.85,;-.77,1.85,;-1.54,.52,;-3.08,.52,;-3.85,-.82,;-5.39,-.82,;-6.16,.52,;-5.39,1.85,;-3.85,1.85,;-7.7,.52,;-8.47,1.85,;-10.01,1.85,;-10.78,.52,;-10.01,-.82,;-10.49,-2.28,;-9.24,-3.19,;-7.99,-2.28,;-8.47,-.82,;1.54,3.19,;3.08,3.19,)|
O=C(CC1COCCO1)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:10.10,wD:13.14,(5.39,-.67,;6.16,.67,;7.7,.67,;8.47,-.67,;10.01,-.67,;10.78,-2,;10.01,-3.33,;8.47,-3.33,;7.7,-2,;5.39,2,;3.85,2,;3.08,.67,;1.54,.67,;.77,2,;-.77,2,;-1.54,.67,;-3.08,.67,;-3.85,-.67,;-5.39,-.67,;-6.16,.67,;-5.39,2,;-3.85,2,;-7.7,.67,;-8.47,2,;-10.01,2,;-10.78,.67,;-10.01,-.67,;-10.49,-2.13,;-9.24,-3.04,;-7.99,-2.13,;-8.47,-.67,;1.54,3.33,;3.08,3.33,)|
O=C(C[C@H]1COCCO1)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:10.10,3.2,wD:13.14,(5.39,-.67,;6.16,.67,;7.7,.67,;8.47,-.67,;10.01,-.67,;10.78,-2,;10.01,-3.33,;8.47,-3.33,;7.7,-2,;5.39,2,;3.85,2,;3.08,.67,;1.54,.67,;.77,2,;-.77,2,;-1.54,.67,;-3.08,.67,;-3.85,-.67,;-5.39,-.67,;-6.16,.67,;-5.39,2,;-3.85,2,;-7.7,.67,;-8.47,2,;-10.01,2,;-10.78,.67,;-10.01,-.67,;-10.49,-2.13,;-9.24,-3.04,;-7.99,-2.13,;-8.47,-.67,;1.54,3.33,;3.08,3.33,)|
O=C(C[C@@H]1COCCO1)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:10.10,wD:13.14,3.2,(5.39,-.67,;6.16,.67,;7.7,.67,;8.47,-.67,;10.01,-.67,;10.78,-2,;10.01,-3.33,;8.47,-3.33,;7.7,-2,;5.39,2,;3.85,2,;3.08,.67,;1.54,.67,;.77,2,;-.77,2,;-1.54,.67,;-3.08,.67,;-3.85,-.67,;-5.39,-.67,;-6.16,.67,;-5.39,2,;-3.85,2,;-7.7,.67,;-8.47,2,;-10.01,2,;-10.78,.67,;-10.01,-.67,;-10.49,-2.13,;-9.24,-3.04,;-7.99,-2.13,;-8.47,-.67,;1.54,3.33,;3.08,3.33,)|
O=C(CC1CCCO1)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:9.9,wD:12.13,(5.54,-.82,;6.31,.52,;7.85,.52,;8.62,-.82,;10.16,-.82,;10.63,-2.28,;9.39,-3.19,;8.14,-2.28,;5.54,1.85,;4,1.85,;3.23,.52,;1.69,.52,;.92,1.85,;-.62,1.85,;-1.39,.52,;-2.93,.52,;-3.7,-.82,;-5.24,-.82,;-6.01,.52,;-5.24,1.85,;-3.7,1.85,;-7.55,.52,;-8.32,1.85,;-9.86,1.85,;-10.63,.52,;-9.86,-.82,;-10.34,-2.28,;-9.09,-3.19,;-7.85,-2.28,;-8.32,-.82,;1.69,3.19,;3.23,3.19,)|
CCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:5.4,wD:8.8,(9.63,1.85,;8.85,.52,;7.31,.52,;6.54,-.82,;6.54,1.85,;5,1.85,;4.23,.52,;2.69,.52,;1.93,1.85,;.38,1.85,;-.38,.52,;-1.93,.52,;-2.69,-.82,;-4.23,-.82,;-5,.52,;-4.23,1.85,;-2.69,1.85,;-6.54,.52,;-7.31,1.85,;-8.85,1.85,;-9.63,.52,;-8.85,-.82,;-9.33,-2.28,;-8.08,-3.19,;-6.84,-2.28,;-7.31,-.82,;2.69,3.19,;4.23,3.19,)|
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COCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:6.5,wD:9.9,(10.4,-.82,;8.86,-.82,;8.09,.52,;6.55,.52,;5.78,-.82,;5.78,1.85,;4.24,1.85,;3.46,.52,;1.93,.52,;1.15,1.85,;-.39,1.85,;-1.15,.52,;-2.7,.52,;-3.46,-.82,;-5.01,-.82,;-5.78,.52,;-5.01,1.85,;-3.46,1.85,;-7.32,.52,;-8.09,1.85,;-9.63,1.85,;-10.4,.52,;-9.63,-.82,;-10.1,-2.28,;-8.86,-3.19,;-7.61,-2.28,;-8.09,-.82,;1.93,3.19,;3.46,3.19,)|
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Clc1ccc(NC(=O)N[C@H]2CC[C@H](CCN3CCN(CC3)c3cccc4OCOc34)CC2)cc1 |r,wU:9.8,wD:12.12,(10.78,4.52,;10.01,3.19,;8.47,3.19,;7.7,1.85,;8.47,.52,;7.7,-.82,;6.16,-.82,;5.39,-2.15,;5.39,.52,;3.85,.52,;3.08,-.82,;1.54,-.82,;.77,.52,;-.77,.52,;-1.54,-.82,;-3.08,-.82,;-3.85,-2.15,;-5.39,-2.15,;-6.16,-.82,;-5.39,.52,;-3.85,.52,;-7.7,-.82,;-8.47,.52,;-10.01,.52,;-10.78,-.82,;-10.01,-2.15,;-10.49,-3.61,;-9.24,-4.52,;-7.99,-3.61,;-8.47,-2.15,;1.54,1.85,;3.08,1.85,;10.01,.52,;10.78,1.85,)|
CN(C)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:7.6,wD:10.10,(9.76,-.17,;8.27,-.57,;7.87,-2.06,;7.18,.52,;5.85,-.25,;8.52,1.29,;6.41,1.85,;4.87,1.85,;4.1,.52,;2.56,.52,;1.79,1.85,;.25,1.85,;-.52,.52,;-2.06,.52,;-2.83,-.82,;-4.37,-.82,;-5.14,.52,;-4.37,1.85,;-2.83,1.85,;-6.68,.52,;-7.45,1.85,;-8.99,1.85,;-9.76,.52,;-8.99,-.82,;-9.46,-2.28,;-8.22,-3.19,;-6.97,-2.28,;-7.45,-.82,;2.56,3.19,;4.1,3.19,)|
O=S(=O)(N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1)N1CCOCC1 |r,wU:4.3,wD:7.7,(5.31,-.25,;6.64,.52,;7.98,1.29,;5.87,1.85,;4.33,1.85,;3.56,.52,;2.02,.52,;1.25,1.85,;-.29,1.85,;-1.06,.52,;-2.6,.52,;-3.37,-.82,;-4.91,-.82,;-5.68,.52,;-4.91,1.85,;-3.37,1.85,;-7.22,.52,;-7.99,1.85,;-9.53,1.85,;-10.3,.52,;-9.53,-.82,;-10,-2.28,;-8.76,-3.19,;-7.51,-2.28,;-7.99,-.82,;2.02,3.19,;3.56,3.19,;7.73,-.57,;7.33,-2.06,;8.44,-3.12,;9.91,-2.72,;10.3,-1.25,;9.22,-.17,)|
NC(=O)OC(CCN1CCN(CC1)c1ccccc1)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)c1ccccc1
COc1ccc(cc1)N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
NC(=O)OC(CCN1CCN(CC1)c1ccc(F)cc1)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)c1ccc(Cl)cc1)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)c1ccccn1)c1ccccc1
COc1cccc(c1)N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
COc1ccccc1N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
NC(=O)OC(CCN1CCN(CC1)c1cccc(Cl)c1)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)c1ccccc1F)c1ccccc1
NC(=O)OC(CCN1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)c1ccccc1
NC(=O)OC(CCCN1CCN(CC1)c1ccccc1)c1ccccc1
COc1ccccc1N1CCN(CCCC(OC(N)=O)c2ccccc2)CC1
C1CN(CCN1)c1cccc2cccnc12
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
CCCc1nc(C(=O)NCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
COc1ccc(cc1)-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1C
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc(Cl)cc1
CCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
CCc1nc(C(=O)NCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1
CCc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Br)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Br)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CC(C)Cn1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c1C
CC(C)Cn1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c1C
CC(C)Cn1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c1C
CCCn1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c1C
CCCn1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c1C
COc1ccccc1-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c1C |(15.99,-4.6,;15.99,-6.14,;14.65,-6.9,;13.32,-6.13,;11.97,-6.9,;11.98,-8.45,;13.32,-9.21,;14.64,-8.44,;15.98,-9.22,;16.45,-10.68,;15.68,-12.01,;17.99,-10.68,;18.47,-9.22,;19.8,-8.45,;19.8,-6.91,;21.14,-9.22,;22.47,-8.45,;23.8,-9.22,;25.14,-8.45,;26.47,-9.21,;27.79,-8.43,;29.12,-9.2,;29.13,-10.74,;27.8,-11.51,;26.45,-10.74,;30.46,-11.5,;31.79,-10.72,;33.13,-11.49,;33.14,-13.03,;31.8,-13.8,;31.8,-15.34,;30.47,-13.03,;29.13,-13.81,;17.22,-8.31,;17.22,-6.77,)|
COc1ccccc1-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c1C |(-3.59,-10.98,;-4.5,-9.73,;-6.03,-9.89,;-6.66,-11.3,;-8.19,-11.46,;-9.09,-10.22,;-8.47,-8.81,;-6.93,-8.65,;-6.31,-7.24,;-7.08,-5.91,;-8.61,-5.75,;-6.05,-4.76,;-4.64,-5.39,;-3.31,-4.62,;-3.31,-3.08,;-1.97,-5.39,;-.64,-4.62,;.69,-5.39,;.69,-6.93,;2.03,-4.62,;3.36,-5.39,;4.7,-4.62,;6.03,-5.39,;6.03,-6.93,;4.7,-7.7,;3.36,-6.93,;7.36,-7.7,;7.36,-9.24,;8.7,-10.01,;10.03,-9.24,;10.03,-7.7,;11.36,-6.93,;8.7,-6.93,;8.7,-5.39,;-4.8,-6.92,;-3.66,-7.95,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1Cl |(16.51,-45.78,;17.28,-44.45,;18.82,-44.45,;19.3,-42.99,;20.64,-42.22,;20.64,-40.68,;21.97,-42.99,;23.3,-42.22,;24.64,-42.99,;25.97,-42.22,;27.3,-42.98,;28.62,-42.2,;29.95,-42.97,;29.96,-44.51,;28.63,-45.28,;27.29,-44.52,;31.29,-45.27,;32.63,-44.49,;33.96,-45.26,;33.97,-46.8,;32.63,-47.57,;32.63,-49.11,;31.3,-46.81,;29.96,-47.58,;18.05,-42.08,;18.05,-40.54,;16.81,-42.99,;15.48,-42.21,;15.48,-40.67,;14.15,-39.9,;12.81,-40.67,;12.81,-42.22,;14.15,-42.98,;14.15,-44.52,)|
Cc1nc(C(=O)NCCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1Cl |(-7.07,-3.08,;-6.44,-4.49,;-4.93,-4.81,;-4.77,-6.34,;-3.44,-7.11,;-3.44,-8.65,;-2.1,-6.34,;-.77,-7.11,;.56,-6.34,;1.9,-7.11,;3.23,-6.34,;4.56,-7.11,;5.9,-6.34,;7.23,-7.11,;7.23,-8.65,;5.9,-9.42,;4.56,-8.65,;8.57,-9.42,;8.57,-10.96,;9.9,-11.73,;11.23,-10.96,;11.23,-9.42,;12.57,-8.65,;9.9,-8.65,;9.9,-7.11,;-6.18,-6.96,;-6.5,-8.47,;-7.21,-5.82,;-8.74,-5.98,;-9.65,-4.74,;-11.18,-4.9,;-11.8,-6.3,;-10.9,-7.55,;-9.37,-7.39,;-8.46,-8.63,)|
CC(C)c1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
COc1cc(OC)cc(c1)-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c1C
CC(C)c1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
CCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(C)c1C
COc1cc(OC)cc(c1)-n1c(C)nc(C(=O)NCCN2CCN(CC2)c2cccc(C)c2C)c1C
CC(C)c1nc(C(=O)NCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
Cc1nc(C(=O)NCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(F)cc1
Cc1nc(C(=O)NCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc2OCOc2c1
CCCc1nc(cn1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCc1nc(cn1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(C)c1C
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(OC)cc1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccn1
COc1ccc(cc1)-n1cc(nc1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccc(cc1)-n1cc(nc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc(OC)cc1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc(OC)cc1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(OC)cc1
COc1ccc(cc1)-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c1C
Cc1nc(C(=O)NC[C@H](O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1 |r|
Cc1nc(C(=O)NC[C@H](O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1F |r,wU:8.8,(-5.84,-16.71,;-5.06,-15.38,;-3.52,-15.38,;-3.04,-13.92,;-1.71,-13.15,;-1.71,-11.61,;-.38,-13.92,;.96,-13.15,;2.29,-13.92,;2.29,-15.46,;3.62,-13.15,;4.95,-13.92,;6.28,-13.14,;7.61,-13.9,;7.62,-15.44,;6.28,-16.22,;4.94,-15.45,;8.95,-16.21,;10.28,-15.43,;11.62,-16.19,;11.62,-17.73,;10.28,-18.51,;10.28,-20.05,;8.95,-17.74,;7.62,-18.51,;-4.29,-13.01,;-4.3,-11.47,;-5.54,-13.92,;-6.87,-13.15,;-6.86,-11.61,;-8.2,-10.84,;-9.54,-11.6,;-9.53,-13.16,;-8.2,-13.92,;-8.19,-15.46,)|
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NC[C@H](O)CN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NC[C@H](O)CN1CCN(CC1)c1cccc(Cl)c1C |r|
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc(OC)cc1
COc1ccccc1-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c1C |(-6,-2.67,;-6,-4.21,;-7.34,-4.97,;-8.67,-4.2,;-10.01,-4.97,;-10.01,-6.52,;-8.67,-7.28,;-7.34,-6.51,;-6.01,-7.29,;-5.54,-8.75,;-6.31,-10.08,;-4,-8.75,;-3.52,-7.29,;-2.18,-6.52,;-2.18,-4.98,;-.85,-7.29,;.48,-6.52,;1.82,-7.29,;3.15,-6.52,;4.48,-7.28,;5.8,-6.5,;7.13,-7.27,;7.14,-8.81,;5.81,-9.58,;4.47,-8.82,;8.47,-9.57,;9.81,-8.79,;11.14,-9.56,;11.15,-11.1,;9.81,-11.87,;9.81,-13.41,;8.48,-11.11,;7.14,-11.88,;-4.77,-6.38,;-4.77,-4.84,)|
COc1ccccc1-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1C |(17.91,6.36,;17.91,4.82,;16.57,4.06,;15.24,4.83,;13.9,4.06,;13.9,2.51,;15.24,1.75,;16.56,2.52,;17.9,1.74,;18.37,.28,;17.46,-.96,;19.91,.28,;20.39,1.74,;21.72,2.51,;21.72,4.05,;23.06,1.74,;24.39,2.51,;25.73,1.74,;27.06,2.51,;28.39,1.75,;29.71,2.53,;31.04,1.76,;31.05,.22,;29.72,-.55,;28.37,.21,;32.38,-.54,;32.39,-2.08,;33.72,-2.84,;35.06,-2.07,;35.05,-.53,;36.38,.25,;33.71,.24,;33.71,1.78,;19.14,2.65,;19.14,4.19,)|
COc1ccccc1-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2Cl)c1C |(16.81,-19.25,;16.8,-20.79,;15.47,-21.56,;14.13,-20.78,;12.79,-21.55,;12.79,-23.1,;14.13,-23.87,;15.46,-23.1,;16.79,-23.87,;17.27,-25.33,;16.49,-26.66,;18.81,-25.33,;19.29,-23.87,;20.62,-23.1,;20.62,-21.56,;21.95,-23.87,;23.29,-23.1,;24.62,-23.87,;24.62,-25.41,;25.95,-23.1,;27.28,-23.86,;28.61,-23.09,;29.94,-23.85,;29.95,-25.39,;28.61,-26.16,;27.27,-25.4,;31.28,-26.15,;32.61,-25.38,;33.95,-26.14,;33.95,-27.68,;32.61,-28.46,;32.61,-30,;31.28,-27.69,;29.95,-28.46,;18.04,-22.96,;18.03,-21.42,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(C)cc1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(C)cc1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc2OCCOc2c1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc2OCCOc2c1
Cc1nc(C(=O)NC[C@@H](O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1 |r|
Cc1nc(C(=O)NC[C@@H](O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1F |r,wD:8.8,(16.59,-9.13,;17.37,-7.8,;18.91,-7.8,;19.39,-6.34,;20.72,-5.57,;20.72,-4.03,;22.05,-6.34,;23.39,-5.57,;24.72,-6.34,;24.72,-7.88,;26.06,-5.57,;27.39,-6.33,;28.71,-5.55,;30.04,-6.32,;30.05,-7.86,;28.71,-8.63,;27.37,-7.87,;31.38,-8.62,;32.71,-7.84,;34.05,-8.61,;34.05,-10.15,;32.71,-10.92,;32.71,-12.46,;31.38,-10.16,;30.05,-10.93,;18.14,-5.43,;18.14,-3.89,;16.89,-6.34,;15.56,-5.56,;15.57,-4.03,;14.24,-3.25,;12.89,-4.02,;12.9,-5.57,;14.23,-6.34,;14.24,-7.88,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1F |(13.53,.69,;14.3,2.02,;15.84,2.02,;16.32,3.49,;17.66,4.26,;17.66,5.8,;18.99,3.49,;20.32,4.26,;21.66,3.49,;22.99,4.26,;24.32,3.49,;25.64,4.27,;26.97,3.51,;26.98,1.96,;25.65,1.19,;24.31,1.96,;28.32,1.2,;29.65,1.98,;30.98,1.22,;30.99,-.33,;29.65,-1.1,;29.65,-2.64,;28.32,-.33,;26.99,-1.1,;15.07,4.39,;15.07,5.93,;13.83,3.49,;12.5,4.26,;12.5,5.8,;11.17,6.57,;9.83,5.8,;9.84,4.25,;11.17,3.49,;11.17,1.95,)|
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CS(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:8.8,wD:5.4,(8.79,2.67,;8.02,1.33,;6.69,2.1,;9.35,.56,;7.25,,;5.71,,;4.94,1.33,;3.4,1.33,;2.63,,;1.09,,;.32,-1.33,;-1.22,-1.33,;-1.99,-2.67,;-3.53,-2.67,;-4.3,-1.33,;-3.53,,;-1.99,,;-5.84,-1.33,;-6.74,-2.58,;-8.21,-2.1,;-8.21,-.56,;-9.35,.47,;-9.03,1.97,;-7.57,2.45,;-6.42,1.42,;-6.74,-.09,;3.4,-1.33,;4.94,-1.33,)|
CCS(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:9.9,wD:6.5,(9.84,2.67,;8.3,2.67,;7.53,1.33,;6.2,2.1,;8.87,.56,;6.76,,;5.22,,;4.45,1.33,;2.91,1.33,;2.14,,;.6,,;-.17,-1.33,;-1.71,-1.33,;-2.48,-2.67,;-4.02,-2.67,;-4.79,-1.33,;-4.02,,;-2.48,,;-6.33,-1.33,;-7.23,-2.58,;-8.7,-2.1,;-8.7,-.56,;-9.84,.47,;-9.52,1.97,;-8.06,2.45,;-6.91,1.42,;-7.23,-.09,;2.91,-1.33,;4.45,-1.33,)|
Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:14.15,wD:11.11,(10.23,4.67,;9.46,3.33,;10.23,2,;9.46,.67,;7.92,.67,;7.15,2,;7.92,3.33,;7.15,-.67,;5.81,.1,;8.48,-1.44,;6.38,-2,;4.84,-2,;4.07,-.67,;2.53,-.67,;1.76,-2,;.22,-2,;-.55,-3.33,;-2.09,-3.33,;-2.86,-4.67,;-4.4,-4.67,;-5.17,-3.33,;-4.4,-2,;-2.86,-2,;-6.71,-3.33,;-7.62,-4.58,;-9.08,-4.1,;-9.08,-2.56,;-10.23,-1.53,;-9.91,-.03,;-8.44,.45,;-7.3,-.58,;-7.62,-2.09,;2.53,-3.33,;4.07,-3.33,)|
FC(F)(F)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(8.69,2.77,;8.69,1.23,;10.23,1.23,;8.69,-.31,;7.15,1.23,;6.38,2.56,;6.38,-.1,;4.84,-.1,;4.07,1.23,;2.53,1.23,;1.76,-.1,;.22,-.1,;-.55,-1.44,;-2.09,-1.44,;-2.86,-2.77,;-4.4,-2.77,;-5.17,-1.44,;-4.4,-.1,;-2.86,-.1,;-6.71,-1.44,;-7.62,-2.68,;-9.08,-2.21,;-9.08,-.67,;-10.23,.36,;-9.91,1.87,;-8.44,2.35,;-7.3,1.32,;-7.62,-.19,;2.53,-1.44,;4.07,-1.44,)|
CC(C)(C)CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:11.11,wD:8.7,(10.51,.77,;9.18,,;7.84,-.77,;9.95,-1.33,;8.41,1.33,;6.87,1.33,;6.1,2.67,;6.1,,;4.56,,;3.79,1.33,;2.25,1.33,;1.48,,;-.06,,;-.83,-1.33,;-2.37,-1.33,;-3.14,-2.67,;-4.68,-2.67,;-5.45,-1.33,;-4.68,,;-3.14,,;-6.99,-1.33,;-7.9,-2.58,;-9.36,-2.1,;-9.36,-.56,;-10.51,.47,;-10.19,1.97,;-8.72,2.45,;-7.58,1.42,;-7.9,-.09,;2.25,-1.33,;3.79,-1.33,)|
Cc1cc(on1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:12.13,wD:9.9,(11.31,-.21,;9.98,.56,;8.51,.09,;7.61,1.33,;8.51,2.58,;9.98,2.1,;6.07,1.33,;5.3,2.67,;5.3,,;3.76,,;2.99,1.33,;1.45,1.33,;.68,,;-.86,,;-1.63,-1.33,;-3.17,-1.33,;-3.94,-2.67,;-5.48,-2.67,;-6.25,-1.33,;-5.48,,;-3.94,,;-7.79,-1.33,;-8.7,-2.58,;-10.16,-2.1,;-10.16,-.56,;-11.31,.47,;-10.99,1.97,;-9.52,2.45,;-8.38,1.42,;-8.7,-.09,;1.45,-1.33,;2.99,-1.33,)|
CN(C)C(=O)CCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:13.13,wD:10.9,(9.46,2.67,;10.23,1.33,;11.77,1.33,;9.46,,;10.23,-1.33,;7.92,,;7.15,1.33,;5.61,1.33,;4.84,2.67,;4.84,,;3.3,,;2.53,1.33,;.99,1.33,;.22,,;-1.32,,;-2.09,-1.33,;-3.63,-1.33,;-4.4,-2.67,;-5.94,-2.67,;-6.71,-1.33,;-5.94,,;-4.4,,;-8.25,-1.33,;-9.16,-2.58,;-10.62,-2.1,;-10.62,-.56,;-11.77,.47,;-11.45,1.97,;-9.98,2.45,;-8.84,1.42,;-9.16,-.09,;.99,-1.33,;2.53,-1.33,)|
CN(C)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(9.84,2,;8.3,2,;7.53,3.33,;7.53,.67,;6.2,1.44,;8.87,-.1,;6.76,-.67,;5.22,-.67,;4.45,.67,;2.91,.67,;2.14,-.67,;.6,-.67,;-.17,-2,;-1.71,-2,;-2.48,-3.33,;-4.02,-3.33,;-4.79,-2,;-4.02,-.67,;-2.48,-.67,;-6.33,-2,;-7.23,-3.25,;-8.7,-2.77,;-8.7,-1.23,;-9.84,-.2,;-9.52,1.31,;-8.06,1.78,;-6.91,.75,;-7.23,-.75,;2.91,-2,;4.45,-2,)|
FC(F)(F)CCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:12.12,wD:9.8,(9.84,1.54,;9.84,,;11.38,,;9.84,-1.54,;8.3,,;7.53,1.33,;5.99,1.33,;5.22,2.67,;5.22,,;3.68,,;2.91,1.33,;1.37,1.33,;.6,,;-.94,,;-1.71,-1.33,;-3.25,-1.33,;-4.02,-2.67,;-5.56,-2.67,;-6.33,-1.33,;-5.56,,;-4.02,,;-7.87,-1.33,;-8.77,-2.58,;-10.24,-2.1,;-10.24,-.56,;-11.38,.47,;-11.06,1.97,;-9.6,2.45,;-8.45,1.42,;-8.77,-.09,;1.37,-1.33,;2.91,-1.33,)|
CC(C)CCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:11.11,wD:8.7,(11,1.33,;10.23,,;11,-1.33,;8.69,,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,-2.67,;-5.17,-2.67,;-5.94,-1.33,;-5.17,,;-3.63,,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
CC[C@@H](O)CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:11.11,2.2,wD:8.7,(11,1.33,;10.23,,;8.69,,;7.92,-1.33,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
CC[C@H](O)CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:11.11,wD:8.7,2.2,(11,1.33,;10.23,,;8.69,,;7.92,-1.33,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
O=C(CC1CCC1)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:11.12,wD:8.8,(6.02,2.67,;6.79,1.33,;8.33,1.33,;9.1,,;8.7,-1.49,;10.19,-1.89,;10.59,-.4,;6.02,,;4.48,,;3.71,1.33,;2.17,1.33,;1.4,,;-.14,,;-.91,-1.33,;-2.45,-1.33,;-3.22,,;-4.76,,;-5.53,-1.33,;-4.76,-2.67,;-3.22,-2.67,;-7.07,-1.33,;-7.98,-2.58,;-9.44,-2.1,;-9.44,-.56,;-10.59,.47,;-10.27,1.97,;-8.8,2.45,;-7.66,1.42,;-7.98,-.09,;2.17,-1.33,;3.71,-1.33,)|
Clc1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:13.14,wD:10.10,(11.77,1.33,;10.23,1.33,;9.46,,;7.92,,;7.15,1.33,;7.92,2.67,;9.46,2.67,;5.61,1.33,;4.84,2.67,;4.84,,;3.3,,;2.53,1.33,;.99,1.33,;.22,,;-1.32,,;-2.09,-1.33,;-3.63,-1.33,;-4.4,,;-5.94,,;-6.71,-1.33,;-5.94,-2.67,;-4.4,-2.67,;-8.25,-1.33,;-9.16,-2.58,;-10.62,-2.1,;-10.62,-.56,;-11.77,.47,;-11.45,1.97,;-9.98,2.45,;-8.84,1.42,;-9.16,-.09,;.99,-1.33,;2.53,-1.33,)|
FC(F)(F)c1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.17,wD:13.13,(11,2.77,;11,1.23,;11,-.31,;12.54,1.23,;9.46,1.23,;8.69,2.56,;7.15,2.56,;6.38,1.23,;7.15,-.1,;8.69,-.1,;4.84,1.23,;4.07,2.56,;4.07,-.1,;2.53,-.1,;1.76,1.23,;.22,1.23,;-.55,-.1,;-2.09,-.1,;-2.86,-1.44,;-4.4,-1.44,;-5.17,-.1,;-6.71,-.1,;-7.48,-1.44,;-6.71,-2.77,;-5.17,-2.77,;-9.02,-1.44,;-9.93,-2.68,;-11.39,-2.21,;-11.39,-.67,;-12.54,.36,;-12.22,1.87,;-10.75,2.35,;-9.61,1.32,;-9.93,-.19,;.22,-1.44,;1.76,-1.44,)|
O=C(N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1)c1ccc(cc1)N1CCCCC1 |r,wU:6.6,wD:3.2,(3.3,2.67,;4.07,1.33,;3.3,,;1.76,,;.99,1.33,;-.55,1.33,;-1.32,,;-2.86,,;-3.63,-1.33,;-5.17,-1.33,;-5.94,,;-7.48,,;-8.25,-1.33,;-7.48,-2.67,;-5.94,-2.67,;-9.79,-1.33,;-10.7,-2.58,;-12.16,-2.1,;-12.16,-.56,;-13.31,.47,;-12.99,1.97,;-11.52,2.45,;-10.38,1.42,;-10.7,-.09,;-.55,-1.33,;.99,-1.33,;5.61,1.33,;6.38,,;7.92,,;8.69,1.33,;7.92,2.67,;6.38,2.67,;10.23,1.33,;11,,;12.54,,;13.31,1.33,;12.54,2.67,;11,2.67,)|
COC(CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1)OC |r,wU:10.10,wD:7.6,(11,1.33,;10.23,,;8.69,,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,;7.92,-1.33,;8.69,-2.67,)|
CC(C)=CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(10.61,,;9.07,,;8.3,-1.33,;8.3,1.33,;6.76,1.33,;5.99,2.67,;5.99,,;4.45,,;3.68,1.33,;2.14,1.33,;1.37,,;-.17,,;-.94,-1.33,;-2.48,-1.33,;-3.25,,;-4.79,,;-5.56,-1.33,;-4.79,-2.67,;-3.25,-2.67,;-7.1,-1.33,;-8,-2.58,;-9.47,-2.1,;-9.47,-.56,;-10.61,.47,;-10.29,1.97,;-8.83,2.45,;-7.68,1.42,;-8,-.09,;2.14,-1.33,;3.68,-1.33,)|
C\C=C\CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(11,-1.33,;10.23,,;8.69,,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
CC#CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:9.9,wD:6.5,(11,1.33,;9.46,1.33,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
O=CN[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:6.6,wD:3.2,(7.15,2.67,;7.92,1.33,;7.15,,;5.61,,;4.84,1.33,;3.3,1.33,;2.53,,;.99,,;.22,-1.33,;-1.32,-1.33,;-2.09,,;-3.63,,;-4.4,-1.33,;-3.63,-2.67,;-2.09,-2.67,;-5.94,-1.33,;-6.85,-2.58,;-8.31,-2.1,;-8.31,-.56,;-9.46,.47,;-9.14,1.97,;-7.67,2.45,;-6.53,1.42,;-6.85,-.09,;3.3,-1.33,;4.84,-1.33,)|
CCCCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(11,-1.33,;10.23,,;8.69,,;7.92,1.33,;6.38,1.33,;5.61,2.67,;5.61,,;4.07,,;3.3,1.33,;1.76,1.33,;.99,,;-.55,,;-1.32,-1.33,;-2.86,-1.33,;-3.63,,;-5.17,,;-5.94,-1.33,;-5.17,-2.67,;-3.63,-2.67,;-7.48,-1.33,;-8.39,-2.58,;-9.85,-2.1,;-9.85,-.56,;-11,.47,;-10.68,1.97,;-9.21,2.45,;-8.07,1.42,;-8.39,-.09,;1.76,-1.33,;3.3,-1.33,)|
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CC(C)(C)C1CCC(CC1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.17,wD:13.13,(11,2.77,;11,1.23,;11,-.31,;12.54,1.23,;9.46,1.23,;8.69,-.1,;7.15,-.1,;6.38,1.23,;7.15,2.56,;8.69,2.56,;4.84,1.23,;4.07,2.56,;4.07,-.1,;2.53,-.1,;1.76,1.23,;.22,1.23,;-.55,-.1,;-2.09,-.1,;-2.86,-1.44,;-4.4,-1.44,;-5.17,-2.77,;-6.71,-2.77,;-7.48,-1.44,;-6.71,-.1,;-5.17,-.1,;-9.02,-1.44,;-9.93,-2.68,;-11.39,-2.21,;-11.39,-.67,;-12.54,.36,;-12.22,1.87,;-10.75,2.35,;-9.61,1.32,;-9.93,-.19,;.22,-1.44,;1.76,-1.44,)|
O=C(N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1)C12CC3CC(CC(C3)C1)C2 |r,wU:6.6,wD:3.2,TLB:33:28:35:34.32.31,33:32:35:28.29.27,29:30:34:28.33.27,THB:29:28:34:35.30.31,(5.82,2.18,;6.59,.85,;5.82,-.49,;4.28,-.49,;3.51,.85,;1.97,.85,;1.2,-.49,;-.34,-.49,;-1.11,-1.82,;-2.65,-1.82,;-3.42,-3.16,;-4.96,-3.16,;-5.73,-1.82,;-4.96,-.49,;-3.42,-.49,;-7.27,-1.82,;-8.18,-3.07,;-9.64,-2.59,;-9.64,-1.05,;-10.79,-.02,;-10.47,1.49,;-9,1.96,;-7.86,.93,;-8.18,-.58,;1.97,-1.82,;3.51,-1.82,;8.13,.85,;9.46,.08,;10.79,.85,;10.79,2.39,;9.46,3.16,;8.71,1.99,;8.69,-.41,;9.89,-1.08,;7.29,-1.06,;8.13,2.39,)|
FC(F)(F)C1CCC(CC1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.17,wD:13.13,(11,2.77,;11,1.23,;11,-.31,;12.54,1.23,;9.46,1.23,;8.69,-.1,;7.15,-.1,;6.38,1.23,;7.15,2.56,;8.69,2.56,;4.84,1.23,;4.07,2.56,;4.07,-.1,;2.53,-.1,;1.76,1.23,;.22,1.23,;-.55,-.1,;-2.09,-.1,;-2.86,-1.44,;-4.4,-1.44,;-5.17,-2.77,;-6.71,-2.77,;-7.48,-1.44,;-6.71,-.1,;-5.17,-.1,;-9.02,-1.44,;-9.93,-2.68,;-11.39,-2.21,;-11.39,-.67,;-12.54,.36,;-12.22,1.87,;-10.75,2.35,;-9.61,1.32,;-9.93,-.19,;.22,-1.44,;1.76,-1.44,)|
CC(C)Cc1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.17,wD:13.13,(12.92,,;11.38,,;10.61,-1.33,;10.61,1.33,;9.07,1.33,;8.3,,;6.76,,;5.99,1.33,;6.76,2.67,;8.3,2.67,;4.45,1.33,;3.68,2.67,;3.68,,;2.14,,;1.37,1.33,;-.17,1.33,;-.94,,;-2.48,,;-3.25,-1.33,;-4.79,-1.33,;-5.56,-2.67,;-7.1,-2.67,;-7.87,-1.33,;-7.1,,;-5.56,,;-9.41,-1.33,;-10.31,-2.58,;-11.78,-2.1,;-11.78,-.56,;-12.92,.47,;-12.6,1.97,;-11.14,2.45,;-9.99,1.42,;-10.31,-.09,;-.17,-1.33,;1.37,-1.33,)|
CCc1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:14.15,wD:11.11,(12.15,,;11.38,1.33,;9.84,1.33,;9.07,,;7.53,,;6.76,1.33,;7.53,2.67,;9.07,2.67,;5.22,1.33,;4.45,2.67,;4.45,,;2.91,,;2.14,1.33,;.6,1.33,;-.17,,;-1.71,,;-2.48,-1.33,;-4.02,-1.33,;-4.79,-2.67,;-6.33,-2.67,;-7.1,-1.33,;-6.33,,;-4.79,,;-8.64,-1.33,;-9.54,-2.58,;-11.01,-2.1,;-11.01,-.56,;-12.15,.47,;-11.83,1.97,;-10.37,2.45,;-9.22,1.42,;-9.54,-.09,;.6,-1.33,;2.14,-1.33,)|
O=C(N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1)c1ccc(cc1)C1CCCCC1 |r,wU:6.6,wD:3.2,(3.3,2.67,;4.07,1.33,;3.3,,;1.76,,;.99,1.33,;-.55,1.33,;-1.32,,;-2.86,,;-3.63,-1.33,;-5.17,-1.33,;-5.94,-2.67,;-7.48,-2.67,;-8.25,-1.33,;-7.48,,;-5.94,,;-9.79,-1.33,;-10.7,-2.58,;-12.16,-2.1,;-12.16,-.56,;-13.31,.47,;-12.99,1.97,;-11.52,2.45,;-10.38,1.42,;-10.7,-.09,;-.55,-1.33,;.99,-1.33,;5.61,1.33,;6.38,,;7.92,,;8.69,1.33,;7.92,2.67,;6.38,2.67,;10.23,1.33,;11,,;12.54,,;13.31,1.33,;12.54,2.67,;11,2.67,)|
CC(C)c1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:15.16,wD:12.12,(12.15,,;11.38,1.33,;12.15,2.67,;9.84,1.33,;9.07,,;7.53,,;6.76,1.33,;7.53,2.67,;9.07,2.67,;5.22,1.33,;4.45,2.67,;4.45,,;2.91,,;2.14,1.33,;.6,1.33,;-.17,,;-1.71,,;-2.48,-1.33,;-4.02,-1.33,;-4.79,-2.67,;-6.33,-2.67,;-7.1,-1.33,;-6.33,,;-4.79,,;-8.64,-1.33,;-9.54,-2.58,;-11.01,-2.1,;-11.01,-.56,;-12.15,.47,;-11.83,1.97,;-10.37,2.45,;-9.22,1.42,;-9.54,-.09,;.6,-1.33,;2.14,-1.33,)|
O=C(N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1)c1ccc(cc1)C1CC1 |r,wU:6.6,wD:3.2,(4.17,2.67,;4.94,1.33,;4.17,,;2.63,,;1.86,1.33,;.32,1.33,;-.45,,;-1.99,,;-2.76,-1.33,;-4.3,-1.33,;-5.07,-2.67,;-6.61,-2.67,;-7.38,-1.33,;-6.61,,;-5.07,,;-8.92,-1.33,;-9.82,-2.58,;-11.29,-2.1,;-11.29,-.56,;-12.43,.47,;-12.11,1.97,;-10.65,2.45,;-9.5,1.42,;-9.82,-.09,;.32,-1.33,;1.86,-1.33,;6.48,1.33,;7.25,,;8.79,,;9.56,1.33,;8.79,2.67,;7.25,2.67,;11.1,1.33,;12.43,.56,;12.43,2.1,)|
O=C(Cc1noc2ccccc12)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.18,wD:13.14,(4.49,2.67,;5.26,1.33,;6.8,1.33,;7.57,,;7.09,-1.46,;8.34,-2.37,;9.58,-1.46,;11.09,-1.78,;12.12,-.64,;11.64,.82,;10.14,1.14,;9.11,,;4.49,,;2.95,,;2.18,1.33,;.64,1.33,;-.13,,;-1.67,,;-2.44,-1.33,;-3.98,-1.33,;-4.75,-2.67,;-6.29,-2.67,;-7.06,-1.33,;-6.29,,;-4.75,,;-8.6,-1.33,;-9.51,-2.58,;-10.97,-2.1,;-10.97,-.56,;-12.12,.47,;-11.8,1.97,;-10.33,2.45,;-9.19,1.42,;-9.51,-.09,;.64,-1.33,;2.18,-1.33,)|
CS(=O)(=O)c1ccc(cc1)C(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:16.17,wD:13.13,(12.54,1.23,;11,1.23,;11,2.77,;11,-.31,;9.46,1.23,;8.69,-.1,;7.15,-.1,;6.38,1.23,;7.15,2.56,;8.69,2.56,;4.84,1.23,;4.07,2.56,;4.07,-.1,;2.53,-.1,;1.76,1.23,;.22,1.23,;-.55,-.1,;-2.09,-.1,;-2.86,-1.44,;-4.4,-1.44,;-5.17,-2.77,;-6.71,-2.77,;-7.48,-1.44,;-6.71,-.1,;-5.17,-.1,;-9.02,-1.44,;-9.93,-2.68,;-11.39,-2.21,;-11.39,-.67,;-12.54,.36,;-12.22,1.87,;-10.75,2.35,;-9.61,1.32,;-9.93,-.19,;.22,-1.44,;1.76,-1.44,)|
Clc1ccc(C(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3coc4ccccc34)CC2)c(Cl)c1 |r,wU:11.11,wD:8.7,(11.77,1.33,;10.23,1.33,;9.46,2.67,;7.92,2.67,;7.15,1.33,;5.61,1.33,;4.84,2.67,;4.84,,;3.3,,;2.53,1.33,;.99,1.33,;.22,,;-1.32,,;-2.09,-1.33,;-3.63,-1.33,;-4.4,-2.67,;-5.94,-2.67,;-6.71,-1.33,;-5.94,,;-4.4,,;-8.25,-1.33,;-9.16,-2.58,;-10.62,-2.1,;-10.62,-.56,;-11.77,.47,;-11.45,1.97,;-9.98,2.45,;-8.84,1.42,;-9.16,-.09,;.99,-1.33,;2.53,-1.33,;7.92,,;7.15,-1.33,;9.46,,)|
CC(C)(C)c1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2coc3ccccc23)CC1 |r,wU:17.18,wD:14.14,(8.23,4.77,;9.56,4,;10.89,3.23,;10.33,5.33,;8.79,2.67,;7.25,2.67,;6.48,1.33,;7.25,,;8.79,,;9.56,1.33,;6.48,-1.33,;5.15,-.56,;7.81,-2.1,;5.71,-2.67,;4.17,-2.67,;3.4,-1.33,;1.86,-1.33,;1.09,-2.67,;-.45,-2.67,;-1.22,-4,;-2.76,-4,;-3.53,-5.33,;-5.07,-5.33,;-5.84,-4,;-5.07,-2.67,;-3.53,-2.67,;-7.38,-4,;-8.28,-5.25,;-9.75,-4.77,;-9.75,-3.23,;-10.89,-2.2,;-10.57,-.69,;-9.11,-.22,;-7.96,-1.25,;-8.28,-2.76,;1.86,-4,;3.4,-4,)|
OCc1ccc(cc1)-c1nnc(SCCCN2CCN(CC2)c2nsc3ccccc23)o1
OCc1ccc(cc1)-c1nnc(SCCCN2CCC(CC2)c2noc3cc(F)ccc23)o1
Clc1ccc(cc1)-c1nnc(SCCCN2CCN(CC2)c2nsc3ccccc23)o1
Fc1ccc2c(noc2c1)C1CCN(CCCSc2nnc(o2)-c2ccc(Cl)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCSc2nnc(o2)-c2cccc3ccccc23)CC1
CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)ccc23)CC1 |r,wU:4.3,wD:7.7,(6,-5.78,;7.34,-5,;8.67,-5.78,;7.34,-3.47,;6,-2.69,;4.67,-3.47,;3.33,-2.69,;3.33,-1.15,;2,-.38,;2,1.15,;.67,1.93,;-.67,1.15,;-2,1.93,;-2,3.47,;-.67,4.24,;.67,3.47,;-3.33,4.23,;-3.33,5.78,;-6,5.78,;-6,4.23,;-7.34,3.47,;-7.34,1.93,;-8.67,1.15,;-6,1.15,;-4.67,1.93,;-4.67,3.47,;4.67,-.38,;6,-1.15,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)C2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-6,-5.78,;-6,-4.24,;-4.67,-3.47,;-4.67,-1.93,;-6,-1.16,;-6,.38,;-7.34,1.15,;-8.67,-1.16,;-7.34,-1.93,;-7.34,-3.47,;-4.67,1.15,;-3.33,.38,;-2,1.15,;-2,2.69,;-.67,3.46,;.67,2.69,;2,3.46,;3.33,2.69,;4.67,3.46,;4.67,5,;3.33,5.78,;2,5,;6,5.77,;7.34,5,;8.67,5.77,;7.34,3.46,;6,2.69,;6,1.15,;7.34,.38,;8.67,1.15,;8.67,2.69,;-3.33,3.46,;-4.67,2.69,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)ccc23)CC1 |r,wU:7.6,wD:10.10,(9.34,.38,;8,1.15,;8,2.69,;6.67,3.46,;6.67,5,;8,5.77,;5.33,5.77,;4,5,;4,3.46,;2.67,2.69,;1.33,3.46,;,2.69,;-1.33,3.46,;-2.67,2.69,;-2.67,1.15,;-4,.38,;-5.33,1.15,;-5.33,2.69,;-4,3.46,;-6.67,.38,;-8,1.15,;-9.34,-1.16,;-8,-1.93,;-8,-3.47,;-6.67,-4.24,;-6.67,-5.78,;-5.33,-3.47,;-5.33,-1.93,;-6.67,-1.16,;1.33,5,;2.67,5.78,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccc(cc2)N2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-6,-5.78,;-6,-4.24,;-4.67,-3.47,;-4.67,-1.93,;-6,-1.16,;-6,.38,;-7.34,1.15,;-8.67,-1.16,;-7.34,-1.93,;-7.34,-3.47,;-4.67,1.15,;-3.33,.38,;-2,1.15,;-2,2.69,;-.67,3.46,;.67,2.69,;2,3.46,;3.33,2.69,;4.67,3.46,;4.67,5,;3.33,5.78,;2,5,;6,5.77,;7.34,5,;8.67,5.77,;7.34,3.46,;8.67,2.69,;8.67,1.15,;7.34,.38,;6,1.15,;6,2.69,;7.34,-1.15,;6,-1.92,;6,-3.46,;7.34,-4.23,;8.67,-3.46,;8.67,-1.92,;-3.33,3.46,;-4.67,2.69,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccc(nc2)N2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-8.67,3.47,;-7.34,4.23,;-6,3.47,;-4.67,4.23,;-4.67,5.78,;-3.33,6.54,;-3.33,8.08,;-6,8.08,;-6,6.54,;-7.34,5.78,;-2,5.78,;-2,4.23,;-.67,3.47,;.67,4.23,;2,3.47,;2,1.93,;3.33,1.15,;3.33,-.38,;4.67,-1.15,;6,-.38,;6,1.15,;4.67,1.93,;7.34,-1.15,;7.34,-2.69,;8.67,-3.47,;6,-3.47,;4.67,-2.69,;3.33,-3.47,;3.33,-5,;4.67,-5.78,;6,-5,;2,-5.77,;.67,-5,;-.67,-5.77,;-.67,-7.31,;.67,-8.08,;2,-7.31,;.67,5.78,;-.67,6.55,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2cnc(cn2)N2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-8.67,3.47,;-7.34,4.23,;-6,3.47,;-4.67,4.23,;-4.67,5.78,;-3.33,6.54,;-3.33,8.08,;-6,8.08,;-6,6.54,;-7.34,5.78,;-2,5.78,;-2,4.23,;-.67,3.47,;.67,4.23,;2,3.47,;2,1.93,;3.33,1.15,;3.33,-.38,;4.67,-1.15,;6,-.38,;6,1.15,;4.67,1.93,;7.34,-1.15,;7.34,-2.69,;8.67,-3.47,;6,-3.47,;6,-5,;4.67,-5.78,;3.33,-5,;3.33,-3.47,;4.67,-2.69,;2,-5.77,;.67,-5,;-.67,-5.77,;-.67,-7.31,;.67,-8.08,;2,-7.31,;.67,5.78,;-.67,6.55,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccc(nn2)N2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-8.67,3.47,;-7.34,4.23,;-6,3.47,;-4.67,4.23,;-4.67,5.78,;-3.33,6.54,;-3.33,8.08,;-6,8.08,;-6,6.54,;-7.34,5.78,;-2,5.78,;-2,4.23,;-.67,3.47,;.67,4.23,;2,3.47,;2,1.93,;3.33,1.15,;3.33,-.38,;4.67,-1.15,;6,-.38,;6,1.15,;4.67,1.93,;7.34,-1.15,;7.34,-2.69,;8.67,-3.47,;6,-3.47,;6,-5,;4.67,-5.78,;3.33,-5,;3.33,-3.47,;4.67,-2.69,;2,-5.77,;.67,-5,;-.67,-5.77,;-.67,-7.31,;.67,-8.08,;2,-7.31,;.67,5.78,;-.67,6.55,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2cnc(nc2)N2CCOCC2)CC1 |r,wU:19.24,wD:16.17,(-8.67,3.46,;-7.34,4.23,;-6,3.46,;-4.67,4.23,;-4.67,5.77,;-3.33,6.54,;-3.33,8.08,;-6,8.08,;-6,6.54,;-7.34,5.77,;-2,5.77,;-2,4.23,;-.67,3.46,;.67,4.23,;2,3.46,;2,1.92,;3.33,1.15,;3.33,-.39,;4.67,-1.16,;6,-.39,;6,1.15,;4.67,1.93,;7.34,-1.15,;7.34,-2.69,;8.67,-3.46,;6,-3.46,;4.67,-2.69,;3.33,-3.46,;3.33,-5,;4.67,-5.77,;6,-5,;2,-5.77,;.67,-5,;-.67,-5.77,;-.67,-7.31,;.67,-8.08,;2,-7.31,;.67,5.77,;-.67,6.54,)|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccc(N3CCOCC3)c(F)c2)CC1 |r,wU:19.24,wD:16.17,(-5.05,-7.48,;-5.44,-5.99,;-4.36,-4.9,;-4.75,-3.41,;-6.24,-3.01,;-6.64,-1.53,;-8.13,-1.13,;-8.82,-3.7,;-7.33,-4.1,;-6.93,-5.59,;-5.55,-.44,;-4.06,-.84,;-2.98,.25,;-3.37,1.74,;-2.28,2.83,;-.8,2.43,;.29,3.52,;1.78,3.12,;2.87,4.21,;2.47,5.7,;.98,6.1,;-.11,5.01,;3.56,6.79,;5.05,6.39,;6.14,7.48,;5.44,4.9,;4.36,3.81,;4.75,2.32,;6.24,1.93,;6.64,.44,;5.55,-.65,;5.95,-2.14,;7.44,-2.54,;8.53,-1.45,;8.13,.04,;7.33,3.01,;8.82,2.62,;6.93,4.5,;-4.86,2.14,;-5.95,1.05,)|
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Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)C2COc3ccccc3O2)CC1 |r,wU:19.24,wD:16.17,(-5.25,-7.48,;-5.64,-5.99,;-4.56,-4.9,;-4.95,-3.41,;-6.44,-3.01,;-6.84,-1.53,;-8.33,-1.13,;-9.02,-3.7,;-7.53,-4.1,;-7.13,-5.59,;-5.75,-.44,;-4.26,-.84,;-3.17,.25,;-3.57,1.74,;-2.48,2.83,;-1,2.43,;.09,3.52,;1.58,3.12,;2.67,4.21,;2.27,5.7,;.78,6.1,;-.31,5.01,;3.36,6.79,;4.85,6.39,;5.94,7.48,;5.25,4.9,;4.16,3.81,;4.56,2.32,;6.04,1.93,;6.44,.44,;7.93,.04,;9.02,1.13,;8.62,2.62,;7.13,3.01,;6.73,4.5,;-5.06,2.14,;-6.15,1.05,)|
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CS(=O)(=O)CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(Cl)ccc23)CC1 |r,wU:8.7,wD:11.11,(11.59,-3.58,;10.25,-2.81,;9.48,-1.47,;11.02,-1.47,;8.92,-3.58,;7.59,-2.81,;7.59,-1.27,;6.25,-3.58,;4.92,-2.81,;3.58,-3.58,;2.25,-2.81,;2.25,-1.27,;.92,-.5,;-.42,-1.27,;-1.75,-.5,;-3.08,-1.27,;-4.42,-.5,;-4.42,1.04,;-3.08,1.81,;-1.75,1.04,;-5.75,1.81,;-5.99,3.33,;-7.51,3.58,;-8.21,2.2,;-9.7,1.81,;-10.1,.32,;-11.59,-.08,;-9.01,-.77,;-7.52,-.37,;-7.12,1.11,;3.58,-.5,;4.92,-1.27,)|
Clc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)CC2OCCCO2)CC1 |r,wU:19.24,wD:16.17,(-12.06,-1.36,;-10.72,-.59,;-9.39,-1.36,;-8.06,-.59,;-8.06,.95,;-6.91,1.98,;-7.54,3.39,;-9.07,3.23,;-9.39,1.72,;-10.72,.95,;-5.42,1.58,;-5.02,.09,;-3.54,-.3,;-2.45,.78,;-.96,.39,;-.56,-1.1,;.93,-1.5,;1.32,-2.99,;2.81,-3.39,;3.9,-2.3,;3.5,-.81,;2.01,-.41,;5.39,-2.7,;6.72,-1.93,;6.72,-.39,;8.06,-2.7,;9.39,-1.93,;10.72,-2.7,;12.06,-1.93,;12.06,-.39,;10.72,.38,;9.39,-.39,;-2.85,2.27,;-4.33,2.67,)|
CO[C@H]1CC[C@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3noc4ccc(Cl)cc34)CC2)CC1 |r,wU:10.9,2.1,wD:13.13,5.5,(12.84,-1.27,;11.51,-.5,;10.18,-1.27,;10.18,-2.81,;8.84,-3.58,;7.51,-2.81,;6.17,-3.58,;4.84,-2.81,;4.84,-1.27,;3.51,-3.58,;2.17,-2.81,;.84,-3.58,;-.49,-2.81,;-.49,-1.27,;-1.83,-.5,;-3.16,-1.27,;-4.49,-.5,;-5.83,-1.27,;-7.16,-.5,;-7.16,1.04,;-5.83,1.81,;-4.49,1.04,;-8.5,1.81,;-8.74,3.33,;-10.26,3.58,;-10.96,2.2,;-12.44,1.81,;-12.84,.32,;-11.75,-.77,;-12.15,-2.26,;-10.27,-.37,;-9.87,1.11,;.84,-.5,;2.17,-1.27,;7.51,-1.27,;8.84,-.5,)|
CS(=O)(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3ccc(F)cc23)CC1 |r,wU:5.4,wD:8.8,(9.91,.76,;8.43,.36,;8.43,1.9,;8.43,-1.18,;6.89,.36,;5.4,-.04,;5,-1.52,;3.51,-1.92,;2.42,-.83,;.94,-1.23,;-.15,-.14,;-1.64,-.54,;-2.04,-2.03,;-3.53,-2.43,;-4.61,-1.34,;-4.22,.15,;-2.73,.55,;-6.1,-1.74,;-6.73,-3.14,;-8.26,-2.98,;-8.58,-1.48,;-9.91,-.71,;-9.91,.83,;-8.58,1.6,;-8.58,3.14,;-7.25,.83,;-7.25,-.71,;2.82,.65,;4.31,1.05,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(Cl)c(F)cc23)CC1 |r,wU:7.6,wD:10.10,(12.06,-1.93,;10.72,-2.7,;9.39,-1.93,;8.06,-2.7,;6.72,-1.93,;6.72,-.39,;5.39,-2.7,;3.9,-2.3,;2.81,-3.39,;1.32,-2.99,;.93,-1.5,;-.56,-1.1,;-.96,.39,;-2.45,.78,;-3.54,-.3,;-5.02,.09,;-5.42,1.58,;-4.33,2.67,;-2.85,2.27,;-6.91,1.98,;-7.54,3.39,;-9.07,3.23,;-9.39,1.72,;-10.72,.95,;-10.72,-.59,;-12.06,-1.36,;-9.39,-1.36,;-9.39,-2.9,;-8.06,-.59,;-8.06,.95,;2.01,-.41,;3.5,-.81,)|
Fc1cc2c(noc2cc1Cl)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)CC2CCCO2)CC1 |r,wU:20.25,wD:17.18,(-9.3,-2.9,;-9.3,-1.36,;-7.97,-.59,;-7.97,.95,;-6.82,1.98,;-7.45,3.39,;-8.98,3.23,;-9.3,1.72,;-10.63,.95,;-10.63,-.59,;-11.97,-1.36,;-5.34,1.58,;-4.94,.09,;-3.45,-.3,;-2.36,.78,;-.87,.39,;-.47,-1.1,;1.01,-1.5,;1.41,-2.99,;2.9,-3.39,;3.99,-2.3,;3.59,-.81,;2.1,-.41,;5.48,-2.7,;6.81,-1.93,;6.81,-.39,;8.14,-2.7,;9.48,-1.93,;10.72,-2.83,;11.97,-1.93,;11.49,-.46,;9.95,-.46,;-2.76,2.27,;-4.25,2.67,)|
COCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)c(F)cc23)CC1 |r,wU:6.5,wD:9.9,(11.39,-2.7,;10.06,-1.93,;8.72,-2.7,;7.39,-1.93,;7.39,-.39,;6.05,-2.7,;4.57,-2.3,;3.48,-3.39,;1.99,-2.99,;1.59,-1.5,;.1,-1.1,;-.29,.39,;-1.78,.78,;-2.87,-.3,;-4.36,.09,;-4.76,1.58,;-3.67,2.67,;-2.18,2.27,;-6.24,1.98,;-6.87,3.39,;-8.4,3.23,;-8.72,1.72,;-10.06,.95,;-10.06,-.59,;-11.39,-1.36,;-8.72,-1.36,;-8.72,-2.9,;-7.39,-.59,;-7.39,.95,;2.68,-.41,;4.17,-.81,)|
CO[C@@H]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3noc4cc(F)c(F)cc34)CC2)C1 |r,wU:10.9,2.1,wD:13.13,5.5,(13.26,-1.24,;12.17,-2.32,;10.68,-1.93,;10.2,-.46,;8.66,-.46,;8.19,-1.93,;6.85,-2.7,;5.52,-1.93,;5.52,-.39,;4.19,-2.7,;2.7,-2.3,;1.61,-3.39,;.12,-2.99,;-.27,-1.5,;-1.76,-1.1,;-2.16,.39,;-3.65,.78,;-4.74,-.3,;-6.22,.09,;-6.62,1.58,;-5.53,2.67,;-4.05,2.27,;-8.11,1.98,;-8.74,3.39,;-10.27,3.23,;-10.59,1.72,;-11.92,.95,;-11.92,-.59,;-13.26,-1.36,;-10.59,-1.36,;-10.59,-2.9,;-9.26,-.59,;-9.26,.95,;.81,-.41,;2.3,-.81,;9.43,-2.83,)|
CO[C@H]1CC[C@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3noc4cc(F)c(F)cc34)CC2)CC1 |r,wU:10.9,2.1,wD:13.13,5.5,(13.39,-.39,;12.06,.38,;10.72,-.39,;10.72,-1.93,;9.39,-2.7,;8.06,-1.93,;6.72,-2.7,;5.39,-1.93,;5.39,-.39,;4.05,-2.7,;2.57,-2.3,;1.48,-3.39,;-.01,-2.99,;-.41,-1.5,;-1.9,-1.1,;-2.29,.39,;-3.78,.78,;-4.87,-.3,;-6.36,.09,;-6.76,1.58,;-5.67,2.67,;-4.18,2.27,;-8.24,1.98,;-8.87,3.39,;-10.4,3.23,;-10.72,1.72,;-12.06,.95,;-12.06,-.59,;-13.39,-1.36,;-10.72,-1.36,;-10.72,-2.9,;-9.39,-.59,;-9.39,.95,;.68,-.41,;2.17,-.81,;8.06,-.39,;9.39,.38,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)c(F)cc23)CC1 |r,wU:7.6,wD:10.10,(12.06,-1.93,;10.72,-2.7,;9.39,-1.93,;8.06,-2.7,;6.72,-1.93,;6.72,-.39,;5.39,-2.7,;3.9,-2.3,;2.81,-3.39,;1.32,-2.99,;.93,-1.5,;-.56,-1.1,;-.96,.39,;-2.45,.78,;-3.54,-.3,;-5.02,.09,;-5.42,1.58,;-4.33,2.67,;-2.85,2.27,;-6.91,1.98,;-7.54,3.39,;-9.07,3.23,;-9.39,1.72,;-10.72,.95,;-10.72,-.59,;-12.06,-1.36,;-9.39,-1.36,;-9.39,-2.9,;-8.06,-.59,;-8.06,.95,;2.01,-.41,;3.5,-.81,)|
CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)c(F)cc23)CC1 |r,wU:4.3,wD:7.7,(10.06,-2.7,;8.72,-1.93,;8.72,-.39,;7.39,-2.7,;5.9,-2.3,;4.81,-3.39,;3.32,-2.99,;2.93,-1.5,;1.44,-1.1,;1.04,.39,;-.45,.78,;-1.54,-.3,;-3.02,.09,;-3.42,1.58,;-2.33,2.67,;-.85,2.27,;-4.91,1.98,;-5.54,3.39,;-7.07,3.23,;-7.39,1.72,;-8.72,.95,;-8.72,-.59,;-10.06,-1.36,;-7.39,-1.36,;-7.39,-2.9,;-6.05,-.59,;-6.05,.95,;4.01,-.41,;5.5,-.81,)|
OCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)c(F)cc23)CC1 |r,wU:5.4,wD:8.8,(10.72,-1.93,;9.39,-2.7,;8.06,-1.93,;8.06,-.39,;6.72,-2.7,;5.23,-2.3,;4.15,-3.39,;2.66,-2.99,;2.26,-1.5,;.77,-1.1,;.37,.39,;-1.11,.78,;-2.2,-.3,;-3.69,.09,;-4.09,1.58,;-3,2.67,;-1.51,2.27,;-5.58,1.98,;-6.2,3.39,;-7.74,3.23,;-8.06,1.72,;-9.39,.95,;-9.39,-.59,;-10.72,-1.36,;-8.06,-1.36,;-8.06,-2.9,;-6.72,-.59,;-6.72,.95,;3.35,-.41,;4.84,-.81,)|
OCCC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(F)c(F)cc23)CC1 |r,wU:6.5,wD:9.9,(11.59,-3.58,;10.25,-2.81,;8.92,-3.58,;7.59,-2.81,;7.59,-1.27,;6.25,-3.58,;4.92,-2.81,;3.58,-3.58,;2.25,-2.81,;2.25,-1.27,;.92,-.5,;-.42,-1.27,;-1.75,-.5,;-3.08,-1.27,;-4.42,-.5,;-4.42,1.04,;-3.08,1.81,;-1.75,1.04,;-5.75,1.81,;-5.99,3.33,;-7.51,3.58,;-8.21,2.2,;-9.7,1.81,;-10.1,.32,;-11.59,-.08,;-9.01,-.77,;-9.41,-2.26,;-7.52,-.37,;-7.12,1.11,;3.58,-.5,;4.92,-1.27,)|
O[C@H]1CC[C@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3noc4cc(F)c(F)cc34)CC2)CC1 |r,wU:9.8,1.0,wD:12.12,4.4,(12.92,-.5,;11.59,-1.27,;11.59,-2.81,;10.25,-3.58,;8.92,-2.81,;7.59,-3.58,;6.25,-2.81,;6.25,-1.27,;4.92,-3.58,;3.58,-2.81,;2.25,-3.58,;.92,-2.81,;.92,-1.27,;-.42,-.5,;-1.75,-1.27,;-3.08,-.5,;-4.42,-1.27,;-5.75,-.5,;-5.75,1.04,;-4.42,1.81,;-3.08,1.04,;-7.09,1.81,;-7.33,3.34,;-8.85,3.58,;-9.55,2.2,;-11.03,1.81,;-11.43,.32,;-12.92,-.08,;-10.34,-.77,;-10.74,-2.26,;-8.86,-.37,;-8.46,1.11,;2.25,-.5,;3.58,-1.27,;8.92,-1.27,;10.25,-.5,)|
O[C@@H]1CC[C@@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(CC3)c3noc4cc(F)c(F)cc34)CC2)C1 |r,wU:9.8,1.0,wD:12.12,4.4,(12.68,-1.16,;11.14,-1.16,;10.23,.09,;8.77,-.39,;8.77,-1.93,;7.43,-2.7,;6.1,-1.93,;6.1,-.39,;4.77,-2.7,;3.28,-2.3,;2.19,-3.39,;.7,-2.99,;.3,-1.5,;-1.18,-1.1,;-1.58,.39,;-3.07,.78,;-4.16,-.3,;-5.65,.09,;-6.04,1.58,;-4.96,2.67,;-3.47,2.27,;-7.53,1.98,;-8.16,3.39,;-9.69,3.23,;-10.01,1.72,;-11.34,.95,;-11.34,-.59,;-12.68,-1.36,;-10.01,-1.36,;-10.01,-2.9,;-8.68,-.59,;-8.68,.95,;1.39,-.41,;2.88,-.81,;10.23,-2.4,)|
Fc1cc2onc(C3CCN(CC[C@H]4CC[C@@H](CC4)NC(=O)C4CCOCC4)CC3)c2cc1F |r,wU:16.19,wD:13.12,(-11.59,1.07,;-10.1,1.47,;-9.7,2.96,;-8.21,3.36,;-7.51,4.73,;-5.99,4.49,;-5.75,2.97,;-4.42,2.2,;-4.42,.66,;-3.08,-.11,;-1.75,.66,;-.42,-.11,;.92,.66,;2.25,-.11,;2.25,-1.65,;3.58,-2.42,;4.92,-1.65,;4.92,-.11,;3.58,.66,;6.25,-2.42,;7.59,-1.65,;7.59,-.11,;8.92,-2.42,;8.92,-3.96,;10.25,-4.73,;11.59,-3.96,;11.59,-2.42,;10.25,-1.65,;-1.75,2.2,;-3.08,2.97,;-7.12,2.27,;-7.52,.78,;-9.01,.38,;-9.41,-1.1,)|
Fc1cc2onc(C3CCN(CC[C@H]4CC[C@@H](CC4)NC(=O)CC4OCCCO4)CC3)c2cc1F |r,wU:16.19,wD:13.12,(-12.25,-.08,;-10.77,.32,;-10.37,1.81,;-8.88,2.2,;-8.18,3.58,;-6.66,3.33,;-6.42,1.81,;-5.08,1.04,;-5.08,-.5,;-3.75,-1.27,;-2.42,-.5,;-1.08,-1.27,;.25,-.5,;1.58,-1.27,;1.58,-2.81,;2.92,-3.58,;4.25,-2.81,;4.25,-1.27,;2.92,-.5,;5.58,-3.58,;6.92,-2.81,;6.92,-1.27,;8.25,-3.58,;9.59,-2.81,;10.92,-3.58,;12.25,-2.81,;12.25,-1.27,;10.92,-.5,;9.59,-1.27,;-2.42,1.04,;-3.75,1.81,;-7.79,1.11,;-8.19,-.37,;-9.68,-.77,;-10.08,-2.26,)|
CC(=O)N[C@H]1CC[C@H](CCN2CCC(CC2)c2noc3cc(C)ccc23)CC1 |r,wU:4.3,wD:7.7,(10.25,-3.58,;8.92,-2.81,;8.92,-1.27,;7.59,-3.58,;6.25,-2.81,;4.92,-3.58,;3.58,-2.81,;3.58,-1.27,;2.25,-.5,;.92,-1.27,;-.42,-.5,;-1.75,-1.27,;-3.08,-.5,;-3.08,1.04,;-1.75,1.81,;-.42,1.04,;-4.42,1.81,;-4.66,3.33,;-6.18,3.58,;-6.88,2.2,;-8.37,1.81,;-8.77,.32,;-10.25,-.08,;-7.68,-.77,;-6.19,-.37,;-5.79,1.11,;4.92,-.5,;6.25,-1.27,)|
Clc1cccc(N2CCCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
Clc1cccc(N2CCCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
C(CN1CCO[C@H](COc2ccccc2)C1)N1CCc2ccccc12 |r|
O=C(CN1CCO[C@@H](COc2cccnc2)C1)N1CCc2ccccc12 |r|
C(CN1CCO[C@@H](COc2cccnc2)C1)N1CCc2ccccc12 |r|
O=C(CN1CCO[C@H](COc2cccnc2)C1)N1CCc2ccccc12 |r|
Clc1cccc(OC[C@H]2CN(CC(=O)N3CCc4ccccc34)CCO2)c1 |r|
Clc1cccc(OC[C@@H]2CN(CC(=O)N3CCc4ccccc34)CCO2)c1 |r|
Clc1cccc(OC[C@H]2CN(CCN3CCc4ccccc34)CCO2)c1 |r|
Clc1cccc(OC[C@@H]2CN(CCN3CCc4ccccc34)CCO2)c1 |r|
COc1cccc(OC[C@@H]2CN(CC(=O)N3CCc4ccccc34)CCO2)c1 |r|
COc1cccc(OC[C@H]2CN(CC(=O)N3CCc4ccccc34)CCO2)c1 |r|
COc1cccc(OC[C@@H]2CN(CCN3CCc4ccccc34)CCO2)c1 |r|
Cc1ccc(OC[C@H]2CN(CCN3CCc4ccccc34)CCO2)cn1 |r|
Cc1ccnc(C)c1OC[C@H]1CN(CCN2CCc3ccccc23)CCO1 |r|
Fc1ccc(OC[C@@H]2CN(CCN3CCc4ccccc34)CCO2)cc1 |r|
CC1Cc2ccccc2N1C(=O)CN1CCO[C@H](COc2cccc(Cl)c2)C1 |r|
CC1Cc2ccccc2N1C(=O)CN1CCO[C@@H](COc2cccc(Cl)c2)C1 |r|
O=c1ccc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
O=c1[nH]c2ccccc2cc1OCCN1CCN(CC1)c1cccc2sccc12
Cc1cc(=O)[nH]c2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc12
Cc1cc(=O)[nH]c2cc(OCCCCN3CCN(CC3)c3cccc4sccc34)ccc12
Cc1cc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]c1=O
O=c1ccc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
O=c1ccc2ccccc2n1CCCCN1CCN(CC1)c1cccc2sccc12
O=c1ccc2ccccc2n1CCCCCN1CCN(CC1)c1cccc2sccc12
O=C1CCc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2N1
O=C1CCc2ccc(OC\C=C\CN3CCN(CC3)c3cccc4sccc34)cc2N1
CC1CC(=O)Nc2cc(OCCCCN3CCN(CC3)c3cccc4sccc34)ccc12
O=C1CCc2ccc(OCCOCCN3CCN(CC3)c3cccc4sccc34)cc2N1
CN1C(=O)CCc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc12
O=C1CCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc2N1
O=C1CCc2cc(OCCCCN3CCN(CC3)c3cccc4sccc34)ccc2N1
O=C1CCc2ccccc2N1CCCCN1CCN(CC1)c1cccc2sccc12
O=C1CCc2ccccc2N1CCCCCN1CCN(CC1)c1cccc2sccc12
O=C1N(CCCCN2CCN(CC2)c2cccc3sccc23)CCc2ccccc12
O=C1N(CCCCCN2CCN(CC2)c2cccc3sccc23)CCc2ccccc12
O=C1NCCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc12
CN1CCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc2C1=O
CCN1CCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc2C1=O
O=C1NCCc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc12
CN1CCc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2C1=O
CCN1CCc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2C1=O
CN1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2C1=O
O=C1NCCc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc12
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)ccc2ccccc12
O=c1[nH]ccc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc12
Cn1ccc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2c1=O
CCn1ccc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2c1=O
COc1ccc2ccn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)c2c1
Oc1ccc2ccn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)c2c1
O=c1[nH]ccc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc12
Cn1ccc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc2c1=O
CC1CN(CCCOc2ccc3CCC(=O)Nc3c2)CCN1c1cccc2sccc12
CC1CN(CCN1CCCCOc1ccc2CCC(=O)Nc2c1)c1cccc2sccc12
CC1CN(CCN1CCCCOc1ccc2ccc(=O)[nH]c2c1)c1cccc2sccc12
C(COc1cccc2cccnc12)CN1CCN(CC1)c1cccc2sccc12
CC(=O)N1CCCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc12
C(COc1ccc2CCNCc2c1)CN1CCN(CC1)c1cccc2sccc12
CC(=O)N1CCc2ccc(OCCCN3CCN(CC3)c3cccc4sccc34)cc2C1
C(COc1ccc2cccnc2c1)CN1CCN(CC1)c1cccc2sccc12
C(CCN1CCN(CC1)c1cccc2sccc12)COCc1ccc2CCNCc2c1
CC(=O)N1CCc2ccc(COCCCCN3CCN(CC3)c3cccc4sccc34)cc2C1
Fc1cc2CCNC(=O)c2cc1COCCCCN1CCN(CC1)c1cccc2sccc12
CN1CCc2cc(F)c(COCCCCN3CCN(CC3)c3cccc4sccc34)cc2C1=O
Fc1cc(OCCCN2CCN(CC2)c2cccc3sccc23)cc2CCC(=O)Nc12
Cc1cccc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)c(=O)[nH]c12
Fc1cc(OCCCN2CCN(CC2)c2cccc3sccc23)cc2ccc(=O)[nH]c12
O=C1CCc2c(N1)cccc2OCCCN1CCN(CC1)c1cccc2sccc12
CC(=O)Oc1ccc(OCCCN2CCN(CC2)c2cccc3sccc23)c2NC(=O)CCc12
OCc1cc2CCC(=O)Nc2cc1OCCCN1CCN(CC1)c1cccc2sccc12
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2cccc3sccc23)c2CCC(=O)Nc12
Clc1cc2CCC(=O)Nc2c(Cl)c1OCCCN1CCN(CC1)c1cccc2sccc12
Fc1cc(OCCCCN2CCN(CC2)c2cccc3sccc23)cc2ccc(=O)[nH]c12
Cc1cc(=O)[nH]c2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc12
O=C1CCc2cccc(OCCCCN3CCN(CC3)c3cccc4sccc34)c2N1
O=c1ccc2cccc(OCCCCN3CCN(CC3)c3cccc4sccc34)c2[nH]1
Oc1ccc(OCCCN2CCN(CC2)c2cccc3sccc23)c2NC(=O)CCc12
C[C@H](N)Cc1ccc2OCOc2c1 |r|
C[C@@H](N)Cc1ccc2OCOc2c1 |r|
CC(C)N(CCc1c[nH]c2ccccc12)C(C)C
COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1
COc1cc(CCN)c(OC)cc1Br
CCc1cc(OC)c(CCN)cc1OC
CCSc1cc(OC)c(CCN)cc1OC
NCCc1c2CCOc2c(Br)c2CCOc12
COc1cc(C[C@H](C)N)c(OC)cc1Br |r|
COc1cc(C[C@@H](C)N)c(OC)cc1Br |r|
CCSc1cc(OC)c(CC(C)N)cc1OC
COc1cc(C[C@@H](C)N)c(OC)cc1C
COc1cc(C[C@H](C)N)c(OC)cc1C
CCc1cc(OC)c(C[C@H](C)N)cc1OC |r|
CCc1cc(OC)c(C[C@@H](C)N)cc1OC
C[C@H](Cc1cc(c(cc1OC)I)OC)N
COc1cc(C[C@H](C)N)c(OC)cc1I
COc1ccc2[nH]cc(CCN(C)C(C)C)c2c1
COc1ccc2[nH]c(C)c(CCN(C)C)c2c1
CCCN(CCC)CCc1c[nH]c2ccccc12
CN(C)CCc1c[nH]c2cc(F)ccc12
CCOc1cc(OC)c(CC(C)N)cc1OC
CCSc1cc(OC)c(CC(N)CC)cc1OC
CNC(C)Cc1ccc2c(c1)OCO2
CCc1cc(OC)c(C[C@@H](C)N)cc1OC
CS(=O)(=O)c1ccc(cc1)-c1cnc(NCc2ccco2)n2cnnc12
CNC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
COc1cc(\C=C\C(=O)NCC=C)cc(OC)c1OC
CCCCNC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
CCCCCCNC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
CCCCCCCCNC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
CCCCCCCCCCNC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1
COc1cc(\C=C\C(O)=O)cc(OC)c1OC
Cn1cc(Cl)c(n1)C(=O)N1CCN(CCc2ccccc2F)CC1
Cc1[nH]nc(C(=O)N2CCN(CC(=O)c3ccc(F)cc3)CC2)c1F
Cc1[nH]nc(C(=O)N2CCN(CC(=O)c3ccc(F)cc3)CC2)c1Br
Cn1nc(cc1-c1ccco1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
COc1cc(SC)c(OC)cc1CCN
COc1cc(c(OC)cc1CCN)C(F)(F)F
[2H]C([2H])(N)Cc1cc(OC)c(SC)cc1OC
[2H]C([2H])([2H])Oc1cc(SC)c(OC([2H])([2H])[2H])cc1CCN
[2H]C([2H])(N)Cc1cc(OC)c(C(F)(F)F)cc1OC
[2H]C([2H])([2H])Oc1cc(C(F)(F)F)c(OC([2H])([2H])[2H])cc1CCN
COc1cc(SC(F)(F)F)c(OC)cc1CCN
[2H]C([2H])([2H])Oc1cc(SC(F)(F)F)c(OC([2H])([2H])[2H])cc1CCN
COc1cc(C2CCCC2)c(OC)cc1CCN
[2H]C([2H])([2H])Oc1cc(C2CCCC2)c(OC([2H])([2H])[2H])cc1CCN
COc1cc(C(C)(C)C)c(OC)cc1CCN
[2H]C([2H])([2H])Oc1cc(C(C)(C)C)c(OC([2H])([2H])[2H])cc1CCN
[2H]C([2H])([2H])c1cc(OC)c(CCN)cc1OC
COc1cc(SCCCF)c(OC)cc1CCN
COc1cc(SCCC(F)F)c(OC)cc1CCN
COc1cc(SCCC(F)(F)F)c(OC)cc1CCN
COc1cc(OCCCF)c(OC)cc1CCN
COc1cc(SCC(F)F)c(OC)cc1CCN
COc1cc(SC(F)(F)F)c(OC)cc1CCNCC1CC1
C#CCSc1cc(OC)c(CCN)cc1OC
Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3cc(Cl)sc3Oc2c1 |t:5|
C(OC1CCNCC1)c1ccc2ccccc2c1
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccco1 |r,wU:3.2,wD:6.6,(13.36,-22.55,;12.59,-21.22,;13.36,-19.89,;14.89,-19.89,;15.67,-18.56,;17.21,-18.56,;17.97,-19.89,;19.51,-19.89,;20.29,-18.56,;21.83,-18.56,;22.59,-17.22,;24.13,-17.22,;24.9,-18.56,;24.13,-19.89,;22.59,-19.89,;26.44,-18.56,;27.34,-19.8,;28.81,-19.32,;28.81,-17.78,;29.95,-16.75,;29.63,-15.25,;28.16,-14.78,;27.02,-15.81,;27.34,-17.31,;17.21,-21.22,;15.67,-21.22,;11.05,-21.22,;10.15,-19.97,;8.68,-20.45,;8.68,-21.98,;10.15,-22.46,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cccs1 |r,wU:3.2,wD:6.6,(15.49,-22.15,;14.77,-20.77,;15.54,-19.44,;17.08,-19.44,;17.84,-18.11,;19.39,-18.11,;20.15,-19.44,;21.69,-19.44,;22.46,-18.11,;23.99,-18.11,;24.76,-19.44,;26.3,-19.44,;27.06,-18.11,;26.3,-16.77,;24.76,-16.77,;28.61,-18.11,;29.53,-19.33,;31.01,-18.87,;31.01,-17.34,;32.14,-16.31,;31.83,-14.78,;30.34,-14.31,;29.22,-15.34,;29.53,-16.88,;19.39,-20.77,;17.84,-20.77,;13.24,-20.67,;12.42,-19.38,;10.93,-19.79,;10.88,-21.34,;12.32,-21.9,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccc[nH]1 |r,wU:3.2,wD:6.6,(22.96,-24.14,;22.24,-22.76,;23.01,-21.42,;24.55,-21.42,;25.32,-20.09,;26.86,-20.09,;27.63,-21.42,;29.17,-21.42,;29.94,-20.09,;31.48,-20.09,;32.25,-21.42,;33.79,-21.42,;34.56,-20.09,;33.79,-18.75,;32.25,-18.75,;36.1,-20.09,;37.02,-21.32,;38.46,-20.86,;38.46,-19.32,;39.65,-18.3,;39.29,-16.8,;37.85,-16.29,;36.72,-17.32,;37.02,-18.86,;26.86,-22.76,;25.32,-22.76,;20.7,-22.66,;19.88,-21.38,;18.39,-21.79,;18.29,-23.33,;19.73,-23.89,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cc2ccccc2[nH]1 |r,wU:6.6,wD:3.2,(25.87,-26.54,;26.59,-25.21,;25.82,-23.88,;24.29,-23.88,;23.52,-22.54,;21.97,-22.54,;21.2,-23.88,;19.67,-23.88,;18.9,-22.54,;17.36,-22.54,;16.59,-23.88,;15.06,-23.88,;14.29,-22.54,;15.06,-21.21,;16.59,-21.21,;12.75,-22.54,;11.83,-23.78,;10.4,-23.31,;10.4,-21.77,;9.27,-20.75,;9.58,-19.21,;11.07,-18.75,;12.13,-19.78,;11.83,-21.26,;21.97,-25.21,;23.52,-25.21,;28.13,-25.11,;28.95,-23.83,;30.43,-24.24,;31.72,-23.36,;33.1,-24.08,;33.15,-25.62,;31.87,-26.44,;30.48,-25.77,;29.05,-26.29,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cc2ccccc2o1 |r,wU:3.2,wD:6.6,(-5.89,-.2,;-5.89,1.34,;-4.56,2.11,;-3.22,1.34,;-1.89,2.11,;-.56,1.34,;-.56,-.2,;.78,-.97,;2.11,-.2,;3.44,-.97,;3.44,-2.51,;4.78,-3.28,;6.11,-2.51,;6.11,-.97,;4.78,-.2,;7.45,-3.28,;7.45,-4.82,;8.91,-5.3,;9.81,-4.05,;11.35,-3.89,;11.97,-2.48,;11.07,-1.24,;9.54,-1.4,;8.91,-2.8,;-1.89,-.97,;-3.22,-.2,;-7.23,2.11,;-7.39,3.64,;-8.89,3.96,;-9.66,5.3,;-11.2,5.3,;-11.97,3.96,;-11.2,2.63,;-9.66,2.63,;-8.63,1.48,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cc2ccccc2s1 |r,wU:3.2,wD:6.6,(-5.89,-.2,;-5.89,1.34,;-4.56,2.11,;-3.22,1.34,;-1.89,2.11,;-.56,1.34,;-.56,-.2,;.78,-.97,;2.11,-.2,;3.44,-.97,;3.44,-2.51,;4.78,-3.28,;6.11,-2.51,;6.11,-.97,;4.78,-.2,;7.45,-3.28,;7.45,-4.82,;8.91,-5.3,;9.81,-4.05,;11.35,-3.89,;11.97,-2.48,;11.07,-1.24,;9.54,-1.4,;8.91,-2.8,;-1.89,-.97,;-3.22,-.2,;-7.23,2.11,;-7.39,3.64,;-8.89,3.96,;-9.66,5.3,;-11.2,5.3,;-11.97,3.96,;-11.2,2.63,;-9.66,2.63,;-8.63,1.48,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccc(o1)C#N |r,wU:3.2,wD:6.6,(-5.54,.38,;-5.54,1.92,;-4.21,2.69,;-2.87,1.92,;-1.54,2.7,;-.21,1.92,;-.21,.38,;1.13,-.39,;2.46,.38,;3.8,-.39,;3.8,-1.93,;5.13,-2.7,;6.46,-1.93,;6.46,-.39,;5.13,.38,;7.8,-2.7,;7.8,-4.24,;9.26,-4.71,;10.17,-3.47,;11.7,-3.3,;12.32,-1.9,;11.42,-.65,;9.89,-.81,;9.26,-2.22,;-1.54,-.39,;-2.87,.38,;-6.87,2.69,;-6.87,4.23,;-8.34,4.71,;-9.36,3.46,;-8.34,2.22,;-10.9,3.46,;-12.44,3.45,)|
CC(C)(C)c1ccoc1C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:12.12,wD:15.16,(-5.84,3.88,;-7.33,4.27,;-7.72,5.76,;-6.24,5.36,;-8.41,3.18,;-9.88,3.66,;-10.78,2.41,;-9.88,1.17,;-8.41,1.64,;-7.08,.87,;-7.08,-.67,;-5.75,1.64,;-4.41,.87,;-3.08,1.64,;-1.75,.87,;-1.75,-.67,;-.41,-1.44,;.92,-.67,;2.26,-1.44,;2.26,-2.98,;3.59,-3.75,;4.92,-2.98,;4.92,-1.44,;3.59,-.67,;6.26,-3.75,;6.26,-5.29,;7.72,-5.76,;8.63,-4.52,;10.16,-4.35,;10.78,-2.95,;9.88,-1.7,;8.35,-1.86,;7.72,-3.27,;-3.08,-1.44,;-4.41,-.67,)|
Cc1ccc([nH]1)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:9.9,wD:12.13,(-11.55,3.46,;-10.01,3.46,;-9.11,4.71,;-7.64,4.23,;-7.64,2.69,;-9.11,2.22,;-6.31,1.92,;-6.31,.38,;-4.98,2.69,;-3.64,1.92,;-2.31,2.7,;-.98,1.92,;-.98,.38,;.36,-.39,;1.69,.38,;3.03,-.39,;3.03,-1.93,;4.36,-2.7,;5.69,-1.93,;5.69,-.39,;4.36,.38,;7.03,-2.7,;7.03,-4.24,;8.49,-4.71,;9.4,-3.47,;10.93,-3.3,;11.55,-1.9,;10.65,-.65,;9.12,-.81,;8.49,-2.22,;-2.31,-.39,;-3.64,.38,)|
CC(=O)c1ccc(o1)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:11.11,wD:14.15,(-11.94,2.09,;-11.17,3.42,;-11.94,4.75,;-9.63,3.42,;-8.72,4.67,;-7.26,4.19,;-7.26,2.65,;-8.72,2.18,;-5.93,1.88,;-5.93,.34,;-4.59,2.65,;-3.26,1.88,;-1.92,2.65,;-.59,1.88,;-.59,.34,;.74,-.43,;2.08,.34,;3.41,-.43,;3.41,-1.97,;4.74,-2.74,;6.08,-1.97,;6.08,-.43,;4.74,.34,;7.41,-2.74,;7.41,-4.28,;8.88,-4.75,;9.78,-3.51,;11.31,-3.35,;11.94,-1.94,;11.03,-.7,;9.5,-.86,;8.88,-2.26,;-1.92,-.43,;-3.26,.34,)|
Cc1ccsc1C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:9.9,wD:12.13,(-7.08,4.86,;-8.41,4.09,;-9.88,4.56,;-10.78,3.32,;-9.88,2.07,;-8.41,2.55,;-7.08,1.78,;-7.08,.24,;-5.75,2.55,;-4.41,1.78,;-3.08,2.55,;-1.75,1.78,;-1.75,.24,;-.41,-.53,;.92,.24,;2.26,-.53,;2.26,-2.07,;3.59,-2.84,;4.92,-2.07,;4.92,-.53,;3.59,.24,;6.26,-2.84,;6.26,-4.38,;7.72,-4.86,;8.63,-3.61,;10.16,-3.45,;10.78,-2.04,;9.88,-.8,;8.35,-.96,;7.72,-2.37,;-3.08,-.53,;-4.41,.24,)|
Brc1ccsc1C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:9.9,wD:12.13,(-7.08,4.86,;-8.41,4.09,;-9.88,4.56,;-10.78,3.32,;-9.88,2.07,;-8.41,2.55,;-7.08,1.78,;-7.08,.24,;-5.75,2.55,;-4.41,1.78,;-3.08,2.55,;-1.75,1.78,;-1.75,.24,;-.41,-.53,;.92,.24,;2.26,-.53,;2.26,-2.07,;3.59,-2.84,;4.92,-2.07,;4.92,-.53,;3.59,.24,;6.26,-2.84,;6.26,-4.38,;7.72,-4.86,;8.63,-3.61,;10.16,-3.45,;10.78,-2.04,;9.88,-.8,;8.35,-.96,;7.72,-2.37,;-3.08,-.53,;-4.41,.24,)|
CCc1c(sc2ccccc12)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:14.15,wD:17.19,(-7.08,6.4,;-7.08,4.86,;-8.41,4.09,;-8.41,2.55,;-9.88,2.07,;-10.78,3.32,;-12.32,3.48,;-12.94,4.89,;-12.04,6.13,;-10.51,5.97,;-9.88,4.56,;-7.08,1.78,;-7.08,.24,;-5.75,2.55,;-4.41,1.78,;-3.08,2.55,;-1.75,1.78,;-1.75,.24,;-.41,-.53,;.92,.24,;2.26,-.53,;2.26,-2.07,;3.59,-2.84,;4.92,-2.07,;4.92,-.53,;3.59,.24,;6.26,-2.84,;6.26,-4.38,;7.72,-4.86,;8.63,-3.61,;10.16,-3.45,;10.78,-2.04,;9.88,-.8,;8.35,-.96,;7.72,-2.37,;-3.08,-.53,;-4.41,.24,)|
Clc1c(sc2ccccc12)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:13.14,wD:16.18,(-7.08,4.86,;-8.41,4.09,;-8.41,2.55,;-9.88,2.07,;-10.78,3.32,;-12.32,3.48,;-12.94,4.89,;-12.04,6.13,;-10.51,5.97,;-9.88,4.56,;-7.08,1.78,;-7.08,.24,;-5.75,2.55,;-4.41,1.78,;-3.08,2.55,;-1.75,1.78,;-1.75,.24,;-.41,-.53,;.92,.24,;2.26,-.53,;2.26,-2.07,;3.59,-2.84,;4.92,-2.07,;4.92,-.53,;3.59,.24,;6.26,-2.84,;6.26,-4.38,;7.72,-4.86,;8.63,-3.61,;10.16,-3.45,;10.78,-2.04,;9.88,-.8,;8.35,-.96,;7.72,-2.37,;-3.08,-.53,;-4.41,.24,)|
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[O-][N+](=O)c1cccc(NC(=O)N[C@H]2CC[C@H](CCN3CCN(CC3)c3nsc4ccccc34)CC2)c1 |r,wU:12.11,wD:15.15,(-13,2.27,;-11.65,3.02,;-11.64,4.56,;-10.33,2.24,;-10.27,.62,;-8.93,-.15,;-7.6,.62,;-7.6,2.16,;-6.26,2.93,;-4.93,2.16,;-4.93,.62,;-3.6,2.93,;-2.26,2.16,;-.93,2.93,;.4,2.16,;.4,.62,;1.74,-.15,;3.07,.62,;4.4,-.15,;4.4,-1.69,;5.74,-2.46,;7.07,-1.69,;7.07,-.15,;5.74,.62,;8.41,-2.46,;8.41,-4,;9.87,-4.47,;10.78,-3.23,;12.31,-3.07,;12.93,-1.66,;12.03,-.41,;10.5,-.57,;9.87,-1.98,;-.93,-.15,;-2.26,.62,;-8.93,2.93,)|
O=C(NCc1ccccc1)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:11.11,wD:14.15,(26.22,-29.78,;25.55,-28.45,;24.01,-28.34,;23.14,-29.63,;21.6,-29.58,;20.94,-28.19,;19.4,-28.09,;18.58,-29.42,;19.25,-30.75,;20.78,-30.86,;26.32,-27.12,;27.86,-27.12,;28.63,-25.78,;30.16,-25.78,;30.93,-27.12,;32.47,-27.12,;33.24,-25.78,;34.77,-25.78,;35.54,-27.12,;37.08,-27.12,;37.85,-25.78,;37.08,-24.45,;35.54,-24.45,;39.39,-25.78,;40.26,-27.02,;41.68,-26.55,;41.68,-25.01,;42.81,-23.99,;42.5,-22.45,;41.01,-21.99,;39.95,-23.02,;40.26,-24.5,;30.16,-28.45,;28.63,-28.45,)|
O=C(N[C@@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)Nc1ccccc1 |r,wU:3.2,6.6,(-6.26,1.39,;-6.26,2.93,;-4.93,3.7,;-3.6,2.93,;-3.6,1.39,;-2.26,.62,;-.93,1.39,;.4,.62,;1.74,1.39,;3.07,.62,;3.07,-.92,;4.4,-1.69,;5.74,-.92,;5.74,.62,;4.4,1.39,;7.07,-1.69,;7.07,-3.23,;8.54,-3.7,;9.44,-2.46,;10.97,-2.3,;11.6,-.89,;10.69,.36,;9.16,.2,;8.54,-1.21,;-.93,2.93,;-2.26,3.7,;-7.6,3.7,;-8.93,2.93,;-10.27,3.7,;-11.6,2.93,;-11.6,1.39,;-10.27,.62,;-8.93,1.39,)|
O=C(NCc1ccccc1)N[C@@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:11.11,14.15,(-5.6,.24,;-5.6,1.78,;-6.93,2.55,;-8.27,1.78,;-9.6,2.55,;-9.6,4.09,;-10.93,4.86,;-12.27,4.09,;-12.27,2.55,;-10.93,1.78,;-4.26,2.55,;-2.93,1.78,;-2.93,.24,;-1.6,-.53,;-.26,.24,;1.07,-.53,;2.4,.24,;3.74,-.53,;3.74,-2.07,;5.07,-2.84,;6.41,-2.07,;6.41,-.53,;5.07,.24,;7.74,-2.84,;7.74,-4.38,;9.2,-4.86,;10.11,-3.61,;11.64,-3.45,;12.27,-2.04,;11.36,-.8,;9.83,-.96,;9.2,-2.37,;-.26,1.78,;-1.6,2.55,)|
O=C(N[C@@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)Nc1ccco1 |r,wU:3.2,6.6,(-6.41,1.39,;-6.41,2.93,;-5.08,3.7,;-3.75,2.93,;-3.75,1.39,;-2.41,.62,;-1.08,1.39,;.25,.62,;1.59,1.39,;2.92,.62,;2.92,-.92,;4.26,-1.69,;5.59,-.92,;5.59,.62,;4.26,1.39,;6.92,-1.69,;6.92,-3.23,;8.39,-3.7,;9.29,-2.46,;10.82,-2.3,;11.45,-.89,;10.55,.36,;9.01,.2,;8.39,-1.21,;-1.08,2.93,;-2.41,3.7,;-7.75,3.7,;-9.08,2.93,;-10.55,3.41,;-11.45,2.16,;-10.55,.92,;-9.08,1.39,)|
CN(C)C(=O)NC1CCC(CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |(,-4.62,;1.33,-5.39,;2.67,-4.62,;1.33,-6.93,;,-7.7,;2.67,-7.7,;2.67,-9.24,;4,-10.01,;4,-11.55,;2.67,-12.32,;2.67,-13.86,;4,-14.63,;4,-16.17,;5.33,-16.94,;5.33,-18.48,;4,-19.25,;2.67,-18.48,;2.67,-16.94,;4,-20.79,;2.67,-21.56,;2.67,-23.1,;4,-23.87,;5.33,-23.1,;6.67,-23.87,;5.33,-21.56,;6.67,-20.79,;1.33,-11.55,;1.33,-10.01,)|
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3cc(nc23)-c2ccccc2)cc1
FC(CN1CCN(CC1)C(=O)c1cccn2ccnc12)c1ccc(F)cc1
Clc1ccccc1CCN1CCN(CC1)C(=O)c1cccn2ccnc12
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)n2)cc(OCCOCCOCC(O)=O)c1
COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(NS(C)(=O)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(OCCOCCOCC(O)=O)c1
CC(=O)c1ccc2n(CCCCN3CCN(CC3)c3ccc(F)cc3)c(=O)oc2c1
COc1ccccc1N1CCN(CCCCOc2ccc3OCC(=O)Nc3c2)CC1
Clc1cccc(N2CCN(CCCCOc3ccc4OCC(=O)Nc4c3)CC2)c1Cl
Clc1cc2NC(=O)Cc2cc1CCN1CCN(CC1)c1cccc2SCCc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2SCCc12
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(=O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(F)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
O=C1Cc2cc(CCN3CCN(CC3)c3cccc4sccc34)ccc2N1
O=c1ccc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
O=c1ccc2ccc(CCCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
Clc1cc2NC(=O)Cc2cc1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C=CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12 |c:4|
Cc1nc2c(OCc3ccccc3)cccn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2c(O)cccn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
O=C1CCc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2N1
Clc1cc2CCC(=O)Nc2cc1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2ccc(CCCCCN3CCN(CC3)c3cccc4sccc34)cc2c(=O)[nH]1
O=c1ccc2ccc(CCN3CCN(CC3)c3cccc4SCCc34)cc2[nH]1
Cc1ncsc1CCN1CCN(CC1)c1cccc2sccc12
O=c1[nH]c2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
Cc1nc2n(CCCC2(F)F)c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
O=c1[nH]c2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2s1
O=C1COc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2N1
O=C1CSc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2N1
O=c1ccc2ccc(CCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1
O=c1[nH]cnc2ccc(CCCCCN3CCN(CC3)c3cccc4sccc34)cc12
O=c1[nH]c(CCN2CCN(CC2)c2cccc3sccc23)nc2ccccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCC(CC1)c1cccc2sccc12
Clc1cc2NC(=O)Cc2cc1CCN1CCC(CC1)c1cccc2sccc12
O=C1Cc2c(N1)cccc2CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cncc2sccc12
Clc1cc2NC(=O)Cc2cc1CCN1CCN(CC1)c1cncc2sccc12
O=c1ccc2ccc(CCN3CCN(CC3)c3cncc4sccc34)cc2[nH]1
Cc1nc2C(Cl)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Fc1cc2c(cccc2s1)N1CCN(CCc2ccc3ccc(=O)[nH]c3c2)CC1
C(N1CCN(CC1)c1cccc2sccc12)c1nc2ccccc2[nH]1
C(Cc1ccc2ncsc2c1)N1CCN(CC1)c1cccc2sccc12
Fc1cc2c(cccc2s1)N1CCN(CCc2ccc3CCC(=O)Nc3c2)CC1
Fc1cc2c(cccc2s1)N1CCN(CCc2ccc3NC(=O)CCc3c2)CC1
Fc1cc2OCC(=O)Nc2cc1CCN1CCN(CC1)c1cccc2sccc12
O=c1[nH]c2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2o1
N#Cc1ccc2[nH]cc(CCCCN3CCN(CC3)c3cccc4sccc34)c2c1
Fc1cc(CCCCN2CCN(CC2)c2cccc3sccc23)cc2NC(=O)COc12
Fc1cc2c(cccc2s1)N1CCN(CCCCc2ccc3NC(=O)CCc3c2)CC1
Fc1cc2c(cccc2s1)N1CCN(CCc2ccc3[nH]c(=O)[nH]c3c2)CC1
Fc1cc(N2CCN(CCc3ccc4OCC(=O)Nc4c3)CC2)c2ccsc2c1
Fc1cc2c(cccc2s1)N1CCN(CCc2ccc3NC(=O)Cc3c2)CC1
Cc1nc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2c(=O)[nH]1
O=S1(=O)NCCc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc12
O=C1Cc2cc(CCN3CCC(CC3)c3cccc4sccc34)ccc2N1
O=C1CCc2ccc(CCN3CCC(CC3)c3cccc4sccc34)cc2N1
Fc1cc(N2CCN(CCc3ccc4NC(=O)Cc4c3)CC2)c2ccsc2c1
Fc1cc(N2CCN(CCc3ccc4CCC(=O)Nc4c3)CC2)c2ccsc2c1
Cn1c2cc(CCN3CCN(CC3)c3cccc4sccc34)ccc2[nH]c1=O
Cn1c2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2n(C)c1=O
Cn1c2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2[nH]c1=O
COc1cc2c(cccc2s1)N1CCN(CCc2ccc3NC(=O)CCc3c2)CC1
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)c1cc(F)cc2sccc12
O=C1COc2ccc(CCN3CCC(CC3)c3cccc4sccc34)cc2N1
O=C1CCc2cc(CCN3CCC(CC3)c3cccc4sccc34)ccc2N1
Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1cccc2sccc12
Fc1cc2c(cccc2s1)N1CCN(CCCCc2ccc3NC(=O)Cc3c2)CC1
Fc1cc(N2CCN(CCc3ccc4ccc(=O)[nH]c4c3)CC2)c2ccsc2c1
O=C1CCc2cc(CCCCN3CCC(CC3)c3cccc4sccc34)ccc2N1
COc1ccc2[nH]cc(CCN3CCN(CC3)c3cccc4sccc34)c2c1
COc1ccc2[nH]cc(CCCN3CCN(CC3)c3cccc4sccc34)c2c1
COc1ccc2[nH]cc(CCCCN3CCN(CC3)c3cccc4sccc34)c2c1
N#Cc1ccc2[nH]cc(CCCN3CCN(CC3)c3cccc4sccc34)c2c1
N#Cc1ccc2[nH]cc(CCN3CCN(CC3)c3cccc4sccc34)c2c1
CC(=O)n1cc(CCCCN2CCN(CC2)c2cccc3sccc23)c2cc(ccc12)C#N
O=C1CCc2cc(CCCCN3CCN(CC3)c3cccc4sccc34)ccc2N1
O=C1Cc2cc(CCCCN3CCN(CC3)c3cccc4sccc34)ccc2N1
Fc1cc2c(cccc2s1)N1CCN(CCc2cc3CC(=O)Nc3cc2Cl)CC1
CN1C(=O)COc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc12
CN1C(=O)CCc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc12
Nc1nc2cc(CCN3CCN(CC3)c3cccc4sccc34)ccc2s1
Nc1nc2cccc(CCN3CCN(CC3)c3cccc4sccc34)c2s1
CC(=O)Nc1nc2cc(CCN3CCN(CC3)c3cccc4sccc34)ccc2s1
CC(=O)Nc1nc2cccc(CCN3CCN(CC3)c3cccc4sccc34)c2s1
Nc1nc2c(CCN3CCN(CC3)c3cccc4sccc34)cccc2s1
CC(=O)Nc1nc2c(CCN3CCN(CC3)c3cccc4sccc34)cccc2s1
CC(=O)N1CC(CCN2CCN(CC2)c2cccc3sccc23)c2ccccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2sc(F)cc12
O=C1Nc2ccccc2OC1CCN1CCN(CC1)c1cccc2sccc12
S=C1CCc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2N1
O=C1N[C@@H]2CS[C@H](CCCCCN3CCN(CC3)c3cccc4sccc34)[C@@H]2N1
O=C1COc2ccc(CCCCN3CCN(CC3)c3cccc4sccc34)cc2N1
C(CCc1nnnn1C1CCCCC1)CN1CCN(CC1)c1cccc2sccc12
Fc1cc(CCN2CCN(CC2)c2cccc3sccc23)cc2NC(=O)COc12
COC(CN1CCN(CC1)c1cccc2sccc12)c1cccc2NC(=O)COc12
OC(CN1CCN(CC1)c1cccc2sccc12)c1ccc2NC(=O)Cc2c1
OC(CCCCN1CCN(CC1)c1cccc2sccc12)c1ccc2CCC(=O)Nc2c1
CC(=O)Nc1nc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2s1
Nc1nc2ccc(CCN3CCN(CC3)c3cccc4sccc34)cc2s1
COCC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)ccn1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3)n2)c2ccccc12)C(C)(C)C
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(O)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3F)n2)c2ccccc12)C(C)(C)C
COc1ccccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3Cl)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)c(C)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)ccc3C)n2)c2ccccc12)C(C)(C)C
Cc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(C)c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(Cl)c3)n2)c2ccccc12)C(C)(C)C
COc1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(F)c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(Cl)cc3)n2)c2ccccc12)C(C)(C)C
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(Cl)cc3C)n2)c2ccccc12)C(C)(C)C
CC(C)c1ccccc1Nc1nccc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c3ccccc23)n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3C)n2)c2ccccc12)C(C)(C)C
CCOc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(F)cc3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3C)n2)c2ccccc12)C(C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)ccc1O
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(C)c(O)c3)n2)c2ccccc12)C(C)(C)C
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc1OC
COc1ccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C)c4ccccc34)n2)cc1Cl
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)c(F)c3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3F)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3Cl)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3O)n2)c2ccccc12)C(C)(C)C
COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc(O)cc3)n2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)[Si](C)(C)C
COc1ccc(cn1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)[Si](C)(C)C
C[Si](C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccccc4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OCCN4CCOCC4)c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4[nH]ncc4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4onc(N)c4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4CC(=O)Nc4c3)n2)c2ccccc12)[Si](C)(C)C
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(OCCN2CCOCC2)c1
Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(OCCN5CCOCC5)cc4)[Si](C)(C)C)c4ccccc34)n2)cc2cn[nH]c12
COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c(Cl)c3Cl)n2)cc(OCCN2CCOCC2)c1
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)[Si](C)(C)C)c4ccccc34)n2)cc(OC)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ncnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)[Si](C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(C)c4[nH]ncc4c3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccc4CC(=O)Nc4c3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3ccccc3)c2)c2ccccc12)C(C)(C)C#C
CN(C)CCOc1cccc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C#C)c4ccccc34)n2)n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(F)(F)F)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C#C
COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(C)(C)C#C)c4ccccc34)n2)cc(OC)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(OC(F)(F)F)cc(c3)C(=O)NCCN3CCOCC3)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cc(cc(c3)C(=O)NCCN3CCOCC3)C#C)n2)c2ccccc12)C(C)(C)C#C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc(Nc3cccc(OCCN4CCOCC4)n3)n2)c2ccccc12)C(C)(C)C#C
Cc1[nH]nc(C2CC2)c1S(=O)(=O)N1CCC(Cc2ccc(Cl)c(F)c2)CC1
COC(=O)C(=C1CCN(CC1)S(=O)(=O)c1c(C)n[nH]c1C)c1ccc(Cl)cc1 |(5.7,-1.69,;4.61,-2.78,;3.12,-2.38,;2.04,-3.47,;2.73,-.89,;1.24,-.49,;.84,1,;-.65,1.39,;-1.74,.31,;-1.34,-1.18,;.15,-1.58,;-3.22,.7,;-2.83,2.19,;-3.62,-.78,;-4.71,1.1,;-6.18,.63,;-6.95,-.71,;-7.08,1.87,;-6.18,3.12,;-4.71,2.64,;-3.38,3.41,;3.81,.2,;5.3,-.2,;6.39,.89,;5.99,2.38,;7.08,3.47,;4.51,2.78,;3.42,1.69,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(C#N)c1ccc(Cl)cc1 |(-6.95,-.51,;-6.18,.83,;-7.08,2.07,;-6.18,3.32,;-4.71,2.84,;-3.38,3.61,;-4.71,1.3,;-3.22,.9,;-2.83,2.39,;-3.62,-.58,;-1.74,.51,;-.65,1.59,;.84,1.2,;1.24,-.29,;.15,-1.38,;-1.34,-.98,;2.73,-.69,;3.12,-2.18,;3.52,-3.67,;3.81,.4,;5.3,,;6.39,1.09,;5.99,2.58,;7.08,3.67,;4.51,2.98,;3.42,1.89,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(C#N)c1c(F)cccc1F |(-6.6,-.48,;-5.83,.85,;-6.74,2.1,;-5.83,3.34,;-4.37,2.87,;-3.03,3.64,;-4.37,1.33,;-2.88,.93,;-2.48,2.42,;-3.28,-.56,;-1.39,.53,;-.3,1.62,;1.18,1.22,;1.58,-.27,;.49,-1.35,;-.99,-.96,;3.07,-.66,;3.47,-2.15,;3.87,-3.64,;4.16,.43,;3.76,1.91,;2.27,2.31,;4.85,3,;6.34,2.6,;6.74,1.12,;5.65,.03,;6.05,-1.46,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(C#N)c1ccc(Cl)cc1F |(-6.95,-.51,;-6.18,.83,;-7.08,2.07,;-6.18,3.32,;-4.71,2.84,;-3.38,3.61,;-4.71,1.3,;-3.22,.9,;-2.83,2.39,;-3.62,-.58,;-1.74,.51,;-.65,1.59,;.84,1.2,;1.24,-.29,;.15,-1.38,;-1.34,-.98,;2.73,-.69,;3.12,-2.18,;3.52,-3.67,;3.81,.4,;3.42,1.89,;4.51,2.98,;5.99,2.58,;7.08,3.67,;6.39,1.09,;5.3,,;5.7,-1.49,)|
CCc1n[nH]c(CC)c1S(=O)(=O)N1CCC(CC1)=C(C#N)c1ccc(Cl)cc1 |(-7.76,-.91,;-6.27,-.51,;-5.5,.83,;-6.41,2.07,;-5.5,3.32,;-4.04,2.84,;-2.7,3.61,;-1.37,2.84,;-4.04,1.3,;-2.55,.9,;-2.15,2.39,;-2.95,-.58,;-1.06,.51,;.03,1.59,;1.52,1.2,;1.91,-.29,;.83,-1.38,;-.66,-.98,;3.4,-.69,;3.8,-2.18,;4.2,-3.67,;4.49,.4,;5.98,,;7.07,1.09,;6.67,2.58,;7.76,3.67,;5.18,2.98,;4.09,1.89,)|
[#6]-c1c(c(nn1-[#6])C(F)(F)F)S(=O)(=O)[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\C#N)-c1ccc(Cl)cc1
[#6]-c1nn(-[#6])c(-[#6])c1S(=O)(=O)[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\C#N)-c1c(F)cccc1F
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(C#N)c1ccc(OC(F)(F)F)cc1 |(-7.29,-1.99,;-6.52,-.66,;-7.43,.59,;-6.52,1.83,;-5.06,1.36,;-3.72,2.13,;-5.06,-.18,;-3.57,-.58,;-3.17,.9,;-3.97,-2.07,;-2.08,-.98,;-1.68,-2.47,;-.2,-2.87,;.89,-1.78,;.49,-.29,;-.99,.11,;2.38,-2.18,;2.78,-3.67,;3.18,-5.15,;3.47,-1.09,;4.96,-1.49,;6.05,-.4,;5.69,1.13,;6.78,2.22,;6.38,3.7,;5.98,5.19,;7.86,4.1,;4.89,3.31,;4.16,1.49,;3.07,.4,)|
CC1CN(CC\C1=C(/C#N)c1ccc(Cl)cc1)S(=O)(=O)c1c(C)n[nH]c1C
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=Cc1ccc(Cl)cc1F |(-6.95,-1.6,;-6.18,-.26,;-7.08,.98,;-6.18,2.23,;-4.71,1.75,;-3.38,2.52,;-4.71,.21,;-3.22,-.18,;-2.83,1.3,;-3.62,-1.67,;-1.74,-.58,;-1.34,-2.07,;.15,-2.47,;1.24,-1.38,;.84,.11,;-.65,.51,;2.73,-1.78,;3.81,-.69,;3.42,.8,;4.51,1.89,;5.99,1.49,;7.08,2.58,;6.39,,;5.3,-1.09,;5.7,-2.58,)|
[#6]-c1nn(-[#6])c(-[#6])c1S(=O)(=O)[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]\c1ccc(Cl)cc1F
CC(=C1CCN(CC1)S(=O)(=O)c1c(C)n[nH]c1C)c1ccc(Cl)cc1 |(3.12,-2.92,;2.73,-1.43,;1.24,-1.04,;.15,-2.12,;-1.34,-1.73,;-1.74,-.24,;-.65,.85,;.84,.45,;-3.22,.16,;-2.83,1.65,;-3.62,-1.33,;-4.71,.56,;-6.18,.08,;-6.95,-1.25,;-7.08,1.33,;-6.18,2.57,;-4.71,2.1,;-3.38,2.87,;3.81,-.35,;5.3,-.74,;6.39,.35,;5.99,1.83,;7.08,2.92,;4.51,2.23,;3.42,1.14,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=Cc1ccc(Cl)cc1 |(-6.95,-1.65,;-6.18,-.32,;-7.08,.93,;-6.18,2.18,;-4.71,1.7,;-3.38,2.47,;-4.71,.16,;-3.22,-.24,;-2.83,1.25,;-3.62,-1.73,;-1.74,-.64,;-1.34,-2.12,;.15,-2.52,;1.24,-1.43,;.84,.05,;-.65,.45,;2.73,-1.83,;3.81,-.74,;5.3,-1.14,;6.39,-.05,;5.99,1.43,;7.08,2.52,;4.51,1.83,;3.42,.74,)|
[#6]-c1nn(-[#6])c(-[#6])c1S(=O)(=O)[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](/C#N)-c1ccc(Cl)cc1
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(Cl)cc1 |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(F)c(Cl)c1 |(-5.11,1.2,;-5.88,-.13,;-7.34,-.61,;-7.34,-2.15,;-5.88,-2.62,;-5.11,-3.96,;-4.98,-1.38,;-3.44,-1.38,;-3.44,.16,;-3.44,-2.92,;-1.9,-1.38,;-1.13,-.04,;.41,-.04,;1.18,-1.38,;.41,-2.71,;-1.13,-2.71,;2.72,-1.38,;3.49,-2.71,;3.49,-.04,;2.72,1.29,;3.49,2.62,;5.03,2.62,;5.8,3.96,;5.8,1.29,;7.34,1.29,;5.03,-.04,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(Cl)cc1Cl |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,1.29,;1.95,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(Cl)c(Cl)c1 |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,3.96,;3.49,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(Cl)c(F)c1 |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,3.96,;3.49,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(Cl)cc1F |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,1.29,;1.95,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1ccc(F)cc1F |(-4.34,1.2,;-5.11,-.13,;-6.57,-.61,;-6.57,-2.15,;-5.11,-2.62,;-4.34,-3.96,;-4.21,-1.38,;-2.67,-1.38,;-2.67,.16,;-2.67,-2.92,;-1.13,-1.38,;-.36,-.04,;1.18,-.04,;1.95,-1.38,;1.18,-2.71,;-.36,-2.71,;3.49,-1.38,;4.26,-2.71,;4.26,-.04,;5.8,-.04,;6.57,1.29,;5.8,2.62,;6.57,3.96,;4.26,2.62,;3.49,1.29,;1.95,1.29,)|
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)=C(F)c1cnc2ccccc2c1 |(-5.5,1.2,;-6.27,-.13,;-7.73,-.61,;-7.73,-2.15,;-6.27,-2.62,;-5.5,-3.96,;-5.36,-1.38,;-3.82,-1.38,;-3.82,.16,;-3.82,-2.92,;-2.28,-1.38,;-1.51,-.04,;.03,-.04,;.8,-1.38,;.03,-2.71,;-1.51,-2.71,;2.34,-1.38,;3.11,-2.71,;3.11,-.04,;2.34,1.29,;3.11,2.62,;4.65,2.62,;5.42,3.96,;6.96,3.96,;7.73,2.62,;6.96,1.29,;5.42,1.29,;4.65,-.04,)|
Clc1cccc(COc2ccc(Br)cc2OC2CNC2)c1
Cc1nc(COc2ccc(Cl)cc2OC2CNC2)cs1
FC(F)(F)c1cccc(COc2ccc(Cl)cc2OC2CNC2)n1
FC(F)(F)c1ccnc(COc2ccc(Cl)cc2OC2CNC2)c1
Clc1ccc(O[C@@H]2CCNC2)c(OCc2ccccc2)c1 |r|
CN1CC[C@H](C1)Oc1ccc(Cl)cc1OCc1ccccc1 |r|
Clc1cccc(COc2cc(Cl)ccc2O[C@@H]2CCNC2)c1 |r|
CN1CC[C@H](C1)Oc1ccc(Cl)cc1OCc1cccc(Cl)c1 |r|
Clc1cccc(COc2cc(Cl)ccc2O[C@H]2CCNC2)c1 |r|
C[C@@H](Oc1ccc(Cl)cc1OC1CNC1)c1cccc(c1)C(F)(F)F |r|
CC(Oc1ccc(Br)cc1OC1CNC1)c1cccc(Cl)c1
C[C@@H](Oc1ccc(Br)cc1OC1CNC1)c1cccc(c1)C(F)(F)F |r|
C[C@@H](Oc1ccc(Cl)cc1OC1CCNCC1)c1cccc(c1)C(F)(F)F |r|
Cc1ccc2CCC(Oc3ccc(Cl)cc3OC3CNC3)c2c1
Clc1ccc2CCC(Oc3ccc(Cl)cc3OC3CNC3)c2c1
FC(F)(F)c1ccc2CCC(Oc3ccc(Cl)cc3OC3CNC3)c2c1
Clc1ccc(OC2CCc3ccccc3C2)c(OC2CNC2)c1
COC(COc1ccc(Cl)cc1OC1CNC1)c1ccccc1
COc1ccc2CC(Cc2c1)Oc1ccc(Cl)cc1OC1CNC1
FC(F)(COc1ccc(Cl)cc1OC1CNC1)c1ccccc1
Clc1cccc(CCOc2ccc(Cl)cc2OC2CNC2)c1
Clc1ccc(OCCc2ccccc2)c(OC2CNC2)c1
Clc1ccc(cc1)C1(COc2ccc(Cl)cc2OC2CNC2)CCC1
COc1cccc(CCOc2ccc(Cl)cc2OC2CNC2)c1
Fc1cccc(CCOc2ccc(Cl)cc2OC2CNC2)c1
Clc1ccc(CCOc2ccc(Cl)cc2OC2CNC2)cc1
Fc1ccc(CCOc2ccc(Cl)cc2OC2CNC2)cc1
COc1ccc(CCOc2ccc(Cl)cc2OC2CNC2)cc1
Brc1ccc(OCCc2ccccc2)c(OC2CNC2)c1
FC(F)(F)c1ccc(COc2ccc(cc2OC2CNC2)C(F)(F)F)o1
C[C@@H](Oc1ccc(cc1OC1CNC1)C(F)(F)F)c1cccc(c1)C(F)(F)F |r|
FC(F)(F)c1ccc(OCc2ccccc2)c(OC2CNC2)c1
CC1(CNC1)Oc1cc(Br)ccc1OCCc1ccccc1
Cc1ccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)cc1 |r|
Cc1ccc(Oc2cc(Cl)ccc2O[C@@H]2CCNC2)cc1 |r|
CN1CC[C@H](C1)Oc1ccc(Cl)cc1Oc1ccc(C)cc1 |r|
Fc1ccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)cc1 |r|
Fc1ccc(Oc2cc(Cl)ccc2O[C@@H]2CCNC2)cc1 |r|
CN1CC[C@H](C1)Oc1ccc(Cl)cc1Oc1ccc(F)cc1 |r|
Cc1ccccc1Oc1cc(Cl)ccc1O[C@H]1CCNC1 |r|
Cc1cccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)c1 |r|
Cc1cc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)ccc1F |r|
Clc1ccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)cc1 |r|
Clc1cccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)c1 |r|
Clc1ccc(O[C@H]2CCNC2)c(Oc2ccc(Br)cc2)c1 |r|
CC(C)c1ccc(Oc2cc(Cl)ccc2O[C@H]2CCNC2)cc1 |r|
Cn1ncc(Cl)c1-c1cc(NC(=O)c2cc(Br)cs2)ccc1OCCN |(6.95,.27,;6.18,-1.06,;7.09,-2.31,;6.18,-3.56,;4.72,-3.08,;3.38,-3.85,;4.72,-1.54,;3.38,-.77,;2.05,-1.54,;.72,-.77,;-.62,-1.54,;-1.95,-.77,;-1.95,.77,;-3.28,-1.54,;-4.75,-1.06,;-5.65,-2.31,;-7.14,-1.91,;-4.75,-3.56,;-3.28,-3.08,;.72,.77,;2.05,1.54,;3.38,.77,;4.72,1.54,;4.72,3.08,;6.05,3.85,;7.14,2.76,)|
CN1CCc2ccc(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
COc1ccccc1N1CCN(CCCCOc2ccc3CCN(C)C(=O)c3c2)CC1
CN1CCc2ccc(OCCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2C1=O
CN1CCc2ccc(OCC(O)CN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CN1CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3cccc4ccccc34)cc2C1=O
CCN1CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CN1CCc2c(C)cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CN1CCc2c(F)cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CC1CN(C)C(=O)c2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc12
CN1COc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3CCNC(=O)c3c2)CC1
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccc4OCOc4c3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3nsc4ccccc34)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccc4ccccc4n3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccccc3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccc(Cl)cc3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccccc3Cl)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccc(F)cc3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccccc3F)cc2C1=O
COc1ccc(cc1)N1CCN(CCCOc2ccc3CCN(C)C(=O)c3c2)CC1
COc1ccccc1N1CCN(CCCOc2ccc3CCN(C)C(=O)c3c2)CC1
CN1CCc2ccc(OCCCN3CCN(CC3)c3ccccn3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3ncccn3)cc2C1=O
CN1CCc2ccc(OCCCN3CCC(CC3)C(=O)c3ccc(F)cc3)cc2C1=O
Cn1cnc2ccc(OCCCCN3CCN(Cc4ccccc4)CC3)cc2c1=O
Cn1cnc2ccc(OCCCCN3CCc4ccccc4C3)cc2c1=O
Cn1cnc2ccc(OCCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2c1=O
Cn1cnc2ccc(OCCCCN3CCN(CC3)c3ccc(F)cc3)cc2c1=O
O=c1[nH]cnc2ccc(OCCCCN3CCN(CC3)c3ccccn3)cc12
Cc1nc2ccc(OCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2c(=O)n1C
Clc1cccc(N2CCN(CCCOc3ccc4CCNC(=O)c4c3)CC2)c1Cl
FC1=CC2ON=C(C2C=C1)C1CCN(CCCOc2ccc3NC(=O)CCc3c2)CC1 |c:5,9,t:1|
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ncsc2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccn(C)c2)ccc1OCCN1CCCC1
Cc1ncoc1CC(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccnn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccn(C)n2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CC2CCOC2)ccc1OCCN1CCCC1
Cc1cc(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)co1
Cc1ncnc(C)c1-c1cc(NC(=O)CC2CCCO2)ccc1OCCN1CCCC1
CCc1cc(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)[nH]n1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CCCO2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cc(C(C)C)n[nH]2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CCOC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cncc(F)c2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2C3COCC32)ccc1OCCN1CCCC1
COc4cncc(C(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3)c4
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cc(F)ccn2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccc(F)cn2)ccc1OCCN1CCCC1
CCOCC(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@H]2F)ccc1OCCN1CCCC1
CCOCC(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H]2C[C@H]2F)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cn2cccn2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CN2CCn3cccc3C2)ccc1OCCN1CCCC1
Cc1ncsc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1nc(C)c(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)s1
Cc1ncnc(C)c1-c1cc(NC(=O)CN2CCn3nccc3C2)ccc1OCCN1CCCC1
Cc1cnoc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)CN2CCn3cnnc3C2)ccc1OCCN1CCCC1
Cc1ncoc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)COC2CC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnoc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)COC2CCC2)ccc1OCCN1CCCC1
Cc1nocc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)Cn2cccc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnoc2C)ccc1OCCN1CCCC1
COC4(C(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3)CC4
Cc1ncnc(C)c1-c1cc(NC(=O)c2ncoc2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cscn2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@]23COC[C@@H]2C3)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnsc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cncs2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnsc2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2ccc(F)cc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cccn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(N(C)C(=O)C2CC2)ccc1OCCN1CCCC1
Cc1ncsc1CC(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(N(C)C(=O)c2ccnn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccccc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCF)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C(C)c2ccccc2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCCF)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(c3ccccc3)CC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(O)CC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccc(F)cc2)ccc1OCCN1CCCC1
COC(C)(C)C(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2ccccc2)ccc1OCCN1CCCC1
CCOC1(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)CC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2nccs2)ccc1OCCN1CCCC1
COC4(C(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3)CCC4
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2cncs2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CN2CCCC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2cocn2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CNC2CC2)ccc1OCCN1CCCC1
Cc1nc(CCC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)co1
Cc1ncnc(C)c1-c1cc(NC(=O)CNC2CCCC2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cnco2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OCCN1CCCC1
Cc1nc(CC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)no1
CCOC1CC1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccon2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccno2)ccc1OCCN1CCCC1
Cc1cnn(C)c1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1cc(CC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)on1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(CF)CC2)ccc1OCCN1CCCC1
Cc1noc(CC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)n1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2nccs2)ccc1OCCN1CCCC1
Cc1ncc(CC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)s1
Cc1ncnc(C)c1-c1cc(NC(=O)c2c(F)ccn2C)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cc(C)n(C)n2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC(F)(F)C2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccn(C)c2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccc(F)c2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccn(C)n2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2F)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)CCc2ccn(C)n2)ccc1OCCN1CCCC1
Cc1ccccc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1CCCC1
Cc1cccc(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccc(F)cc2)ccc1OCCN1CCCC1
Cc1ccc(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)cc1
COc4cccc(C(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3)c4
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H]2C[C@@H](F)C2)ccc1OCCN1CCCC1
COc1cccc(CC(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)ncnc3C)c2)c1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H]2C[C@H](F)C2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cccc(F)c2)ccc1OCCN1CCCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1CCC1
COc4ccc(CC(=O)Nc3ccc(OCCN1CCCC1)c(c2c(C)ncnc2C)c3)cc4
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cncc(F)c2)ccc1OCCN1CCCC1
Cc1ncsc1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccc(F)cn2)ccc1OCCN1CCCC1
Cc1ncoc1CC(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1CCC1
[H]CC1CCN(CCOc2ccc(NC(=O)C3CC3)cc2-c2c(C)ncnc2C)C1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccc(F)cc2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN(C(=O)CO)CC1
COc4cccc(C(=O)Nc3ccc(OCCN1CCC1)c(c2c(C)ncnc2C)c3)c4
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN(C(=O)C(=O)O)CC1
COc1cccc(CC(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)ncnc3C)c2)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN(C=O)CC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cccc(F)c2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN(S(C)(=O)=O)CC1
COc4ccc(CC(=O)Nc3ccc(OCCN1CCC1)c(c2c(C)ncnc2C)c3)cc4
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN2C(=O)OCC2C1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2cncc(F)c2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2ccc(F)cn2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC2(COC2)C1
Cc1ncnc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN2C(=O)CCC2C1
CCOC1CC1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CC1)CNC2=O
COc4ccc(C(=O)Nc3ccc(OCCN1CCC1)c(c2c(C)ncnc2C)c3)cc4
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CC1)CC(=O)N2
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2F)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CCC(=O)O2)CC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccc(F)c2)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CCOC2=O)CC1
COC1CCN(CCOc2ccc(NC(=O)C3CC3)cc2-c2c(C)ncnc2C)CC1
Cc1cccc(C(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)ncnc3C)c2)c1
CO[C@H]4CCN(CCOc2ccc(NC(=O)C1CC1)cc2c3c(C)ncnc3C)C4
Cc1ccc(C(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)ncnc3C)c2)cc1
CO[C@@H]4CCN(CCOc2ccc(NC(=O)C1CC1)cc2c3c(C)ncnc3C)C4
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2C#N)ccc1OCCN1CCC1
COCCN(C)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
N#Cc1cccc(C(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)ncnc3C)c2)c1
CCN(CCOC)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
N#Cc1ccc(C(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)ncnc3C)c2)cc1
CCCN(CCOC)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1cnn(C)c1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CCO
Cc1ncnc(C)c1-c1cc(NC(=O)C2(CF)CC2)ccc1OCCN1CCC1
CCN(CCO)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)Cc2nccs2)ccc1OCCN1CCC1
CCCN(CCO)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)c2ncccc2F)ccc1OCCN1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CCF
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnccc2F)ccc1OCCN1CCC1
COCCNCCOc2ccc(NC(=O)C1CC1)cc2c3c(C)ncnc3C
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccncc2F)ccc1OCCN1CCC1
CCN(CCF)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)c2ncncc2F)ccc1OCCN1CCC1
CCCN(CCF)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
CC(=O)N1CCN(CCOc2ccc(NC(=O)C3CC3)cc2-c2c(C)ncnc2C)CC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CCS(C)(=O)=O
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC(CC(=O)O)CC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CCS(C)=O
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
CCN(C)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1[C@@H]2COC[C@H]1C2
CCCN(C)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CC1CC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OC1CNC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)C1CCC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OC1CNC1
CCN(CC)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
CCOC1CC1C(=O)Nc1ccc(OCCN2CCOCC2)c(-c2c(C)ncnc2C)c1
COCCNCCOc1ccc(NC(=O)c2ccccc2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OC1CNC1
COCCNCCOc2ccc(NC(=O)c1cccc(OC)c1)cc2c3c(C)ncnc3C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@@H]1CCNC1
COCCNCCOc1ccc(NC(=O)c2cccc(F)c2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@H]1CCNC1
COCCNCCOc1ccc(NC(=O)c2ccc(F)cc2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1CCN1
COCCNCCOc1ccc(NC(=O)c2c(F)cnn2C)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1CCN1
COCCN(C)CCOc1ccc(NC(=O)c2ccccc2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1CCCN1
COCCN(C)CCOc2ccc(NC(=O)c1cccc(OC)c1)cc2c3c(C)ncnc3C
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1CCCN1
COCCN(C)CCOc1ccc(NC(=O)c2cccc(F)c2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@H]2F)ccc1O[C@@H]1CCCNC1
COCCN(C)CCOc1ccc(NC(=O)c2ccc(F)cc2)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H]2C[C@H]2F)ccc1O[C@@H]1CCCNC1
COCCN(C)CCOc1ccc(NC(=O)c2c(F)cnn2C)cc1-c1c(C)ncnc1C
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1O[C@@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1ncsc1C(=O)Nc1ccc(O[C@@H]2CCCNC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1nc(C)c(C(=O)Nc2ccc(O[C@@H]3CCCNC3)c(-c3c(C)ncnc3C)c2)s1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1cnoc1C(=O)Nc1ccc(O[C@@H]2CCCNC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1C[C@H]2C[C@H]2C1
Cc1ncoc1C(=O)Nc1ccc(O[C@@H]2CCCNC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccn2C)ccc1O[C@@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC(F)C1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1O[C@@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1CC(F)C1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC(O)C1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1CC(O)C1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCOCC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1CCCCN1
Cc1ncncc1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCOCC1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@H]2F)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1OCCN1CCOCC1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H]2C[C@H]2F)ccc1OC[C@H]1CCCCN1
Cc1ncoc1C(=O)Nc1ccc(OCCN2CCOCC2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1CCOCC1
Cc1ncsc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC1CNC1
Cc1nc(C)c(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)ncnc3C)c2)s1
CCCC(=O)Nc1ccc(OC2CNC2)c(-c2c(C)ncnc2C)c1
Cc1cnoc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OC1CNC1
Cc1ncoc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnoc2)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@H](F)C(C)C)ccc1OC[C@H]1CCCCN1
Cc1nocc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)[C@@H](F)C(C)C)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnoc2C)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CCC2)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ncoc2C)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CCOCC2)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cnsc2)ccc1OC[C@H]1CCCCN1
CCOC1CC1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1nscc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ncsc2C)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccn2C)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2cccc(F)c2)ccc1OC[C@H]1CCCCN1
Cc1ncnc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OC[C@H]1CCCCN1
COc1cccc(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)ncnc3C)c2)c1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OC[C@H]1CCCCN1
CC(=N)NCCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)ncnc1C
COC4(C(=O)Nc3ccc(OC[C@H]1CCCCN1)c(c2c(C)ncnc2C)c3)CC4
Cc1ncnc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1O[C@@H]1CCCNC1
Cc1ncnc(C)c1-c1cc(NC(=O)C2(O)CC2)ccc1OC[C@H]1CCCCN1
COCCNCCOc2ccc(NC(=O)C1(F)CC1)cc2c3c(C)ncnc3C
CCC[C@@H](F)C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)ncnc2C)c1
Cc1ccccc1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)ncnc2C)c1
COc1ccccc1CNCCc1cc(OC)c(C)cc1OC
CCCCCc1cc(OC)c(CC(N)CC)nc1OC
CCCCCc1cc(OC)c(CC(C)N)nc1OC
COc1cc(C)c(OC)nc1CC(C)N
COc1cc(Br)c(OC)nc1CC(C)N
CCCCCc1cc(OC)c(CCN)nc1OC
COc1cc(C)c(OC)nc1CCN
COc1cc(Br)c(OC)nc1CCN
CCCCCc1cc(OC)c(CC(N)CC)cc1OC
CCCCCc1nc(OC)c(CC(N)CC)cc1OC
CCCCCc1nc(OC)c(CC(N)CC)nc1OC
COc1cc(Cl)c(OC)nc1CCN
COc1cc(Cl)c(OC)nc1CC(C)N
CCC(N)Cc1nc(OC)c(Cl)cc1OC
CCc1cc(OC)c(CCN)nc1OC
CCc1cc(OC)c(CC(C)N)nc1OC
CCSc1cc(OC)c(CCN)nc1OC
CCSc1cc(OC)c(CC(C)N)nc1OC
CCSc1cc(OC)c(CC(N)CC)nc1OC
COc1ccccc1CNCCc1nc(OC)c(Br)cc1OC
COc1cc(C2CC2)c(OC)nc1CCN
COc1cc(C2CC2)c(OC)nc1CC(C)N
CCCCCCc1cc(OC)c(CCN)nc1OC
COc1cc(CCCCCC(F)(F)F)c(OC)nc1CCN
CCCCc1cc(OC)c(CCN)nc1OC
COc1cc(CCCCF)c(OC)nc1CCN
COc1cc(CCCC(F)(F)F)c(OC)nc1CCN
COc1cc(CCCCCF)c(OC)nc1CCN
COc1cc(CCCC(F)(F)F)c(OC)nc1CCN
CCCc1cc(OC)c(CCN)nc1OC
CCCc1cc(OC)c(CC(N)CC)nc1OC
CCCCCCc1cc(OC)c(CC(C)N)nc1OC
CCC(N)Cc1cc(OC)c(C)cc1OC
CCCc1cc(OC)c(CC(N)CC)cc1OC
CCCCCc1cc(OC)c(CC(C)N)cc1OC
CCCCCc1cc(OC)c(CCN)cc1OC
CCCCCCc1cc(OC)c(CCN)cc1OC
COc1cc(CCCCCF)c(OC)cc1CCN
COc1cc(CCCCC(F)(F)F)c(OC)cc1CCN
CC1CN(CCN1CCCOc1ccc2[nH]c(=O)ccc2c1)c1cccc2sccc12
CC1CN(CCN1CCCCOc1ccc2[nH]c(=O)ccc2c1)c1cccc2sccc12
C(COc1ccc2ncccc2c1)CN1CCN(CC1)c1cccc2sccc12
C(COc1ccc2cnccc2c1)CN1CCN(CC1)c1cccc2sccc12
CC(=O)N1CCc2cc(OCCCN3CCN(CC3)c3cccc4sccc34)ccc2C1
C(CCN1CCN(CC1)c1cccc2sccc12)COc1ccc2CCNCc2c1
CC(=O)N1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2C1
Fc1cc2CCNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2sccc12
CN1CCc2cc(F)c(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2C1=O
Cc1c(OCCCCN2CCN(CC2)c2cccc3sccc23)ccc2CCC(=O)Nc12
Cc1cccc2cc(OCCCCN3CCN(CC3)c3cccc4sccc34)c(=O)[nH]c12
O=C1CCc2c(CCCN3CCN(CC3)c3cccc4sccc34)cccc2N1
CC(=O)Oc1ccc(CCCN2CCN(CC2)c2cccc3sccc23)c2NC(=O)CCc12
OCc1cc2CCC(=C)Nc2cc1CCCN1CCN(CC1)c1cccc2sccc12
CC(=O)Nc1ccc(CCCN2CCN(CC2)c2cccc3sccc23)c2CCC(=O)Nc12
Clc1cc2CCC(=C)Nc2c(Cl)c1CCCN1CCN(CC1)c1cccc2sccc12
Fc1cc(CCCN2CCN(CC2)c2cccc3sccc23)cc2CCC(=O)Nc12
Cc1cc(=O)[nH]c2cccc(CCCN3CCN(CC3)c3cccc4sccc34)c12
O=C1CCc2cccc(CCCN3CCN(CC3)c3cccc4sccc34)c2N1
O=c1ccc2c(CCCN3CCN(CC3)c3cccc4sccc34)cccc2[nH]1
Oc1ccc(CCCCN2CCN(CC2)c2cccc3sccc23)c2NC(=O)CCc12
O=C1N(CCN2CCN(CC2)c2noc3ccccc23)CCc2cccnc12
COc1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2cn1
Cc1cc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2cn1
Fc1ccc2c(noc2c1)C1CCN(CCN2CCc3cccnc3C2=O)CC1
Fc1ccc2onc(C3CCN(CCN4CCc5cccnc5C4=O)CC3)c2c1
Cc1cc2c(noc2cc1F)C1CCN(CCN2CCc3cccnc3C2=O)CC1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2cccnc12
O=c1n(CCN2CCN(CC2)c2nsc3ccccc23)ccc2cccnc12
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2ncccc12
O=c1n(CCN2CCN(CC2)c2nsc3ccccc23)ccc2ncccc12
O=c1n(CCN2CCN(CC2)c2nsc3ccccc23)ccc2ccncc12
Fc1ccc2c(noc2c1)C1CCN(CCn2ccc3cccnc3c2=O)CC1
O=c1n(CCN2CCC(CC2)c2noc3ccccc23)ccc2ccncc12
COc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1
CC1CN(CCN2CCC(CC2)c2noc3ccccc23)C(=O)c2ncccc12
Cn1cnc2c1CCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1cc2c(CCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)n1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2ccncc12
COc1cc2C(=O)N(CCN3CCN(CC3)c3nsc4ccccc34)CCc2cn1
COc1cc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2cn1
Cc1cc2c(cn1)C(=O)N(CCN1CCN(CC1)c1noc3ccccc13)CC21CC1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2cccnc12
O=C1C(CCN2CCN(CC2)c2noc3ccccc23)CCc2cccnc12
O=C1C(CCN2CCC(CC2)c2noc3ccccc23)CCc2cccnc12
O=C1C(CCN2CCN(CC2)c2nsc3ccccc23)CCc2cccnc12
O=C1N(CCN2CCC(CC2)c2nsc3ccccc23)CCc2cccnc12
Fc1ccc2c(nsc2c1)N1CCN(CCN2CCc3cccnc3C2=O)CC1
Cn1ncc2c1CCC(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1ncc2c1CCC(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cn1ncc2c1CCCC(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1ncc2c1CCCC(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1noc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c12
Cc1noc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1noc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cc1nc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2o1
Cn1cc2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)n1
Cc1c2c(CCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)nn1C
Cc1noc2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1nc2c(CCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)o1
Cc1noc2CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cn1cc2c(CCCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)n1
Cn1cc2c(CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)n1
Cn1ncc2c1CCCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1ncc2c1CCCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1nc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2o1
Cc1nc2CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2o1
Cn1ncc2CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cn1cc2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
Cn1cc2CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2n1
Cn1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2n1
Cc1nc2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)o1
Cc1nc2c(CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)o1
Cc1noc2ccn(CCN3CCN(CC3)c3nsc4ccccc34)c(=O)c12
Cn1cnc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cn1cnc2CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cn1cnc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ncncc12
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2ncncc12
Cn1ncc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cn1ccc2c1CCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1ccc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Brc1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2cn1
Cn1ncc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
CCn1ncc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1c2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)nn1C
CC(C)c1nc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2o1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2nc(oc12)C1CC1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2nc(oc12)C1CC1
Brc1nn(Br)c2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
Cn1nc(Br)c2c1CCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
CCc1nc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2o1
CCc1nc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2o1
Cn1nc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2c1Br
Cn1nc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2c1Br
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2nn(cc12)C1CC1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2nn(cc12)C1CC1
CC1CN(CCN2CCN(CC2)c2nsc3ccccc23)C(=O)c2cnn(C)c12
Cn1nc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2c1C(F)(F)F
CC1CN(CCN2CCN(CC2)c2nsc3ccccc23)C(=O)c2ccn(C)c12
Cn1ncc2c1CCCN(CCN1CCN(CC1)c1noc3ccccc13)C2=O
Cn1cc2c(CCN(CCN3CCN(CC3)c3noc4ccccc34)C2=O)n1
CC1CN(CCN2CCC(CC2)c2noc3ccccc23)C(=O)c2ccn(C)c12
CC1CN(CCN2CCN(CC2)c2noc3ccccc23)C(=O)c2ccn(C)c12
FC(F)(F)c1cc2ccn(CCN3CCC(CC3)c3noc4ccccc34)c(=O)c2cn1
Cc1nccc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c12
Cc1cc2c(cn1)C(=O)N(CCN1CCN(CC1)c1noc3ccccc13)CC2(C)C
Cc1nccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1ncc2C(=O)N(CCN3CCC(CC3)c3noc4ccccc34)CCc2n1
Cc1ccc2onc(C3CCN(CCN4CCc5cccnc5C4=O)CC3)c2c1
Cc1ncc2C(=O)N(CCN3CCN(CC3)c3nsc4ccccc34)CCc2n1
Cc1nn(C)c2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1nn(C)c2CCCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c12
CCc1ncc2C(=O)N(CCN3CCN(CC3)c3nsc4ccccc34)CCc2n1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2nc(ncc12)C1CC1
Cc1ncc2c(ccn(CCN3CCN(CC3)c3nsc4ccccc34)c2=O)n1
Cn1ncc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCCc2[nH]ncc12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2cn[nH]c12
Cc1n[nH]c2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCCc2nc[nH]c12
Cn1cnc2c1CCCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2cc(ncc12)C#N
Cn1ccc2c1CCCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
CCc1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2cn1
Cc1nn(C)c2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c12
COc1c2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)nn1C
Cc1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2cn1
Cn1ccc2c1CCCN(CCN1CCN(CC1)c1noc3ccccc13)C2=O
FC(F)(F)c1cc2CCN(CCN3CCN(CC3)c3nsc4ccccc34)C(=O)c2cn1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2cc(OC3COC3)ncc12
Cn1c(F)cc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1cc2ccn(CCN3CCN(CC3)c3noc4ccccc34)c(=O)c2cn1
Cc1nc(C)c2c(ccn(CCN3CCC(CC3)c3noc4ccccc34)c2=O)n1
O=c1n(CCN2CCN(CC2)c2noc3ccccc23)ccc2ncccc12
O=c1n(CCN2CCN(CC2)c2noc3ccccc23)ccc2ccncc12
O=c1n(CCN2CCN(CC2)c2noc3ccccc23)ccc2cccnc12
Cc1ccc2c(noc2c1)C1CCN(CCN2CCc3cccnc3C2=O)CC1
CC1(C)CN(CCN2CCC(CC2)c2noc3cc(F)ccc23)C(=O)c2ncccc12
Cc1cccc2c(noc12)C1CCN(CCN2CCc3cccnc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CCN2CCc3ncccc3C2=O)CC1
CC(CN1CCC(CC1)c1noc2cc(F)ccc12)N1CCc2cccnc2C1=O
Fc1ccc2c(noc2c1)N1CCN(CCN2CCc3cccnc3C2=O)CC1
Clc1ccc2c(noc2c1)N1CCN(CCN2CCc3cccnc3C2=O)CC1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ccsc12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ccoc12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ncccc12
O=c1n(CCN2CCC(CC2)c2noc3ccccc23)ccc2ncncc12
Cn1ncc2c1CCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
Cn1ncc2c1CCN(CCN1CCN(CC1)c1noc3ccccc13)C2=O
Cc1noc2ccn(CCN3CCC(CC3)c3noc4ccccc34)c(=O)c12
Cn1cnc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cn1cnc2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1
O=C1N(CCN2CCN(CC2)c2noc3ccccc23)CC2(CC2)c2ccncc12
Cc1cncc2C(=O)N(CCN3CCN(CC3)c3noc4ccccc34)CCc12
Cc1cncc2C(=O)N(CCN3CCC(CC3)c3noc4ccccc34)CCc12
Cc1nc(C)c2C(=O)N(CCN3CCC(CC3)c3noc4ccccc34)CCc2n1
Fc1cccc2c(noc12)C1CCN(CCN2CCc3cccnc3C2=O)CC1
Fc1cccc2onc(C3CCN(CCN4CCc5cccnc5C4=O)CC3)c12
COc1ccc2onc(C3CCN(CCN4CCc5cccnc5C4=O)CC3)c2c1
Fc1ccc2c(noc2c1)N1CCN(CCC2CCc3cccnc3C2=O)CC1
Clc1ccc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2n1
CC1(CCN2CCN(CC2)c2noc3ccccc23)CCc2cccnc2C1=O
Clc1ccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
Fc1ccc2onc(N3CCN(CCN4CCc5cccnc5C4=O)CC3)c2c1
Fc1cc2onc(C3CCN(CCN4CCc5cccnc5C4=O)CC3)c2cc1F
COc1ccc2c(noc2c1)C1CCN(CCN2CCc3cccnc3C2=O)CC1
Cc1ncc2C(=O)C(CCN3CCC(CC3)c3noc4ccccc34)CCc2n1
Cc1c2c(CCN(CCN3CCC(=CC3)c3noc4ccccc34)C2=O)nn1C |c:12|
Cc1cc2CCN(CCN3CCC(=CC3)c3noc4ccccc34)C(=O)c2cn1 |c:12|
O=C1N(CCN2CCN(CC2)c2noc3ccccc23)CCc2ncccc12
Cc1nc2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2o1
Cn1ncc2CCCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cn1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
Cc1nc2c(CCCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)o1
CC(C)n1ncc2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
CC(C)n1ncc2c1CCN(CCN1CCC(CC1)c1noc3ccccc13)C2=O
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2c1cnn2C1CC1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2c1cnn2C1CC1
CC(C)n1cc2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)n1
CCn1cc2c(CCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)n1
CC(C)c1nc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2o1
Cn1ccc2c1CCCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1cc2c(CCCN(CCN3CCC(CC3)c3noc4ccccc34)C2=O)n1C
Cc1cc2c(CCCN(CCN3CCN(CC3)c3nsc4ccccc34)C2=O)n1C
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2nn(cc12)-c1ccccc1
O=C1N(CCN2CCN(CC2)c2nsc3ccccc23)CCc2[nH]ncc12
Cn1ccc2c1CCN(CCN1CCN(CC1)c1noc3ccccc13)C2=O
Cc1c2c(CCN(CCN3CCN(CC3)c3noc4ccccc34)C2=O)nn1C
FC(F)(F)c1cc2ccn(CCN3CCN(CC3)c3nsc4ccccc34)c(=O)c2cn1
FC(F)(F)c1cc2ccn(CCN3CCN(CC3)c3noc4ccccc34)c(=O)c2cn1
Cn1cc2c(CCN(CCN3CCC(C3)c3noc4ccccc34)C2=O)n1
Cn1ccc2c1CCCN(CCN1CCC(C1)c1noc3ccccc13)C2=O
COc1ncc2C(=O)N(CCN3CCC(CC3)c3noc4ccccc34)CCc2n1
COc1ncc2C(=O)N(CCN3CCN(CC3)c3nsc4ccccc34)CCc2n1
Cc1nc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2o1
Cc1ncc2C(=O)N(CCN3CCN(CC3)c3noc4ccccc34)CCc2n1
CC(C)c1ncc2C(=O)N(CCN3CCN(CC3)c3nsc4ccccc34)CCc2n1
CC(C)c1ncc2c(ccn(CCN3CCN(CC3)c3nsc4ccccc34)c2=O)n1
O=c1n(CCN2CCN(CC2)c2nsc3ccccc23)ccc2nc(ncc12)C1CC1
Cc1ccc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2n1
Cc1ccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
CCc1ccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
Fc1ccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2[nH]ncc12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ocnc12
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2[nH]cnc12
Brc1n[nH]c2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c12
Cc1ncc2c(ccn(CCN3CCN(CC3)c3noc4ccccc34)c2=O)n1
Cc1ncc2c(ccn(CCN3CCC(CC3)c3noc4ccccc34)c2=O)n1
CCC(C)OC(=O)Nc1ccc(OCCN2CCCC2)c(c1)-c1c(Br)cnn1C |(-4,6.93,;-2.67,6.16,;-1.33,6.93,;-1.33,8.47,;,6.16,;,4.62,;-1.33,3.85,;1.33,3.85,;1.33,2.31,;,1.54,;;1.33,-.77,;1.33,-2.31,;0,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-4.07,-2.45,;-5.1,-3.6,;-4.33,-4.93,;-2.83,-4.61,;2.67,,;2.67,1.54,;4,-.77,;5.41,-.14,;5.73,1.36,;6.44,-1.29,;5.67,-2.62,;4.16,-2.3,;3.02,-3.33,)|
Cn1nccc1-c1cc(NC(=O)NCc2ccc(Cl)cc2)ccc1OCCN1CCCC1
CC(=O)c1cccc(NC(=O)Nc2ccc(OCCN3CCCC3)c(c2)-c2ccnn2C)c1
Cn1nccc1-c1cc(NC(=O)Cc2ccc(F)cc2)ccc1OCCN1CCCCC1
CCCc1cnc2N3CCNC[C@H]3CCc2c1 |r|
[H][C@]12CCc3c(Cc4ccccc4)ccnc3N1CCNC2 |r|
COCCc1ccnc2N3CCNC[C@H]3CCc12 |r|
CCCCCc1ccnc2N3CCNC[C@H]3CCc12 |r|
CCCC(C)c1ccnc2N3CCNC[C@H]3CCc12 |r|
CCc1ccnc2N3CCNC[C@H]3CCc12 |r|
CC(C)c1ccnc2N3CCNC[C@H]3CCc12 |r|
CCCCc1ccnc2N3CCNC[C@H]3CCc12 |r|
CCCc1ccnc2N3CCNC[C@H]3CCc12 |r|
CC(C)Cc1ccnc2N3CCNC[C@H]3CCc12 |r|
[H][C@]12CCc3c(Cc4cccc(F)c4)ccnc3N1CCNC2 |r|
Fc1ccccc1Cc1ccnc2N3CCNC[C@H]3CCc12 |r|
Cc1ccnc2N3CCNC[C@H]3CCc12 |r|
CC(C)CCc1ccnc2N3CCNC[C@H]3CCc12 |r|
COCc1ccnc2N3CCNC[C@H]3CCc12 |r|
C(C1CCCCC1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
[H][C@]12CCc3c(CC(C)(C)C)ccnc3N1CCNC2 |r|
OC(C1CCC1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
C1CN2[C@H](CCc3c2nccc3-c2cccs2)CN1 |r|
[H][C@]12CCc3c(Cc4ccc(F)cc4)ccnc3N1CCNC2 |r|
CCCc1cnc2N3CCNC[C@H]3CCc2c1CC |r|
CCc1c(Cc2ccccc2)cnc2N3CCNC[C@H]3CCc12 |r|
C(C1CCCCO1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
C(OCc1ccnc2N3CCNC[C@H]3CCc12)C1CCOCC1 |r|
Brc1ccnc2N3CCNCC3CCc12
C(C1CCC1)c1ccnc2N3CCNCC3CCc12
N#CCCc1ccnc2N3CCNC[C@H]3CCc12 |r|
C(c1ccccn1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
C\C=C\Cc1ccnc2N3CCNC[C@H]3CCc12 |r|
CC(C)OCc1ccnc2N3CCNC[C@H]3CCc12 |r|
Clc1ccc(nc1)-c1ccnc2N3CCNC[C@H]3CCc12 |r|
C1CCC(C1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
[H][C@]12CCc3c(ccnc3N1CCNC2)C1CCC1 |r|
[H][C@]12CCc3c(CCC(F)(F)F)ccnc3N1CCNC2 |r|
Brc1ccnc2N3CCCNC[C@H]3CCc12 |r|
FC(F)(F)CCc1ccnc2N3CCCNC[C@H]3CCc12 |r|
CC1CC2CNCCN2c2ncccc12
CSc1nc(Cl)c2CC[C@@H]3CNCCCN3c2n1 |r|
Clc1ncnc2N3CCCNC[C@H]3CCc12 |r|
C(Cc1ccnc2N3CCNC[C@H]3CCc12)c1ccccc1 |r|
CCc1c(CCC#N)cnc2N3CCNC[C@H]3CCc12 |r|
CCc1c(COC(C)C)cnc2N3CCNC[C@H]3CCc12 |r|
CCc1c(CC2CCCCC2)cnc2N3CCNC[C@H]3CCc12 |r|
CCc1c(CC2CCCCO2)cnc2N3CCNC[C@H]3CCc12 |r|
CCc1c(cnc2N3CCNC[C@H]3CCc12)C1CCC1 |r|
FC(F)(F)CCc1c(Cl)cnc2N3CCNC[C@H]3CCc12 |r|
CN1CCN2[C@H](CCc3c(CCC(F)(F)F)ccnc23)C1 |r|
CSc1nc(Cl)c2CC[C@@H]3CNCCN3c2n1 |r|
C(C1CCCC1)c1ccnc2N3CCNC[C@H]3CCc12 |r|
CCc1c(CC2CCCC2)cnc2N3CCNC[C@H]3CCc12 |r|
Brc1cncc2N3CCNC[C@H]3CCc12 |r|
[H][C@]12CCc3c(CCC)cncc3N1CCNC2 |r|
C(C1CCCCC1)c1cncc2N3CCNC[C@H]3CCc12 |r|
C(c1ccccc1)c1cncc2N3CCNC[C@H]3CCc12 |r|
[H][C@]12CCc3c(CC4CCC4)ccnc3N1CCNC2 |r|
Cc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:15|
Cc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC3(CC3)C(O)=O)CC2)c1 |c:15|
CC(C)c1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:17|
CCc1ccc2c(Oc3cc(C)ccc3N=C2N2CCN(CC3(CC3)C(O)=O)CC2)c1 |c:16|
CCc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:16|
Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3ccc(cc3Oc2c1)C(F)F |t:5|
CSc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:16|
Cc1ccc2c(Oc3cc(ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)C(F)F)c1 |c:14|
CCCc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:17|
Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3ccc(F)cc3Oc2c1 |t:5|
Cc1ccc2c(Oc3cc(F)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:15|
Cc1ccc2c(Oc3cc(F)ccc3N=C2N2CCN(CC3(CC3)C(O)=O)CC2)c1 |c:15|
Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3ccc(C)cc3Oc2c1 |t:5|
Cc1ccc2N=C(N3CCN(CC4(CC4)C(O)=O)CC3)c3ccc(F)cc3Oc2c1 |t:5|
CC(C)(CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12)C(O)=O |t:11|
COc1ccc2c(Oc3cc(Cl)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:16|
Cc1ccc2N=C(N3CCN(CC4(CC4)C(O)=O)CC3)c3ccc(C)cc3Oc2c1 |t:5|
COc1ccc2c(Oc3cc(F)ccc3N=C2N2CCN(CC(C)(C)C(O)=O)CC2)c1 |c:16|
OC(=O)C1(CN2CCN(CC2)C2=Nc3ccc(F)cc3Oc3cc(F)ccc23)CC1 |t:12|
CC(C)(CN1CCN(CC1)C1=Nc2ccccc2Cc2cc(F)ccc12)C(O)=O |t:11|
CC(C)(CN1CCN(CC1)C1=Nc2ccc(F)cc2Oc2cc(F)ccc12)C(O)=O |t:11|
Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3ccccc3Cc2c1 |t:5|
OC(=O)C1(CN2CCN(CC2)C2=Nc3ccccc3Cc3ccccc23)CC1 |t:12|
CC(C)(CN1CCN(CC1)C1=Nc2ccccc2Oc2cccc(F)c12)C(O)=O |t:11|
CC(CN1CCC(CC1)C1=Nc2ccccc2Cc2ccccc12)C(O)=O |t:10|
COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccccc1Br
COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccc(F)cc1
COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccc(cc1)C(C)C
CS(=O)(=O)c1ccc2Sc3ccccc3N(CCCN3CCC(CC3)C(O)=N)c2c1
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@@H](C)O |r|
CCN(CCN1CCC(CC1)n1ncc2cc(F)ccc12)C(=O)CCO
CCN(CCN1CCC(CC1)n1ncc2cc(F)ccc12)C(=O)[C@@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(O)CCC(=O)OC
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)(C)O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)(C)CO
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(O)C(C)C
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CCC(O)CC1 |(-2.34,-3.7,;-3.67,-2.93,;-3.67,-1.39,;-2.34,-.62,;-1.01,-1.39,;.33,-.62,;.33,.92,;1.66,1.69,;2.99,.92,;2.99,-.62,;1.66,-1.39,;4.33,1.69,;4.33,3.23,;5.79,3.7,;6.7,2.46,;8.23,2.3,;8.86,.89,;10.34,.49,;7.95,-.36,;6.42,-.2,;5.79,1.21,;-5.01,-.62,;-5.01,.92,;-6.34,-1.39,;-7.68,-.62,;-9.01,-1.39,;-9.01,-2.93,;-10.34,-3.7,;-7.68,-3.7,;-6.34,-2.93,)|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)CC(C)O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1(O)CCOCC1
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)CO
CCN(CCN1CCC(CC1)c1noc2cc(F)c(C)cc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2ccc(C)cc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(Cl)ccc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)CCO
CCN(CCN1CCC(CC1)C1NOc2cc(F)ccc12)C(=O)C(O)COC
CCN(CCN1CCC(CC1)c1n[nH]c2cc(F)ccc12)C(=O)C(C)O
CCN(CCN1CCC(CC1)c1c[nH]c2cc(F)ccc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)n1ncc2cc(F)ccc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1c[nH]c2ccccc12)C(=O)C(C)O
CCN(CCN1CCC(CC1)c1c[nH]c2ccccc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1(O)CC1
CCN(CCN1CCC(CC1)c1noc2ccccc12)C(=O)C(C)O
CCN(CCN1CCN(CC1)c1noc2ccccc12)C(=O)C(C)O
CCN(CCN1CCN(CC1)c1noc2cc(F)ccc12)C(=O)C(C)O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(O)C#C
CC[C@@H](O)C(=O)N(CC)CCN1CCC(CC1)c1noc2cc(F)ccc12 |r|
CC(O)C(=O)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)CC1CC1
CC(C)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)O
CC(O)C(=O)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)CC#N
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CCCCC1O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(O)C(F)(F)F
CC(C)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)CCO
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(F)(F)CO
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)CO
CCN(CCCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@H](C)O |r|
CCCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(C)O
CC(C)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@H](C)O |r|
CC(C)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(-2.34,-3.7,;-3.67,-2.93,;-3.67,-1.39,;-2.34,-.62,;-1.01,-1.39,;.33,-.62,;.33,.92,;1.66,1.69,;2.99,.92,;2.99,-.62,;1.66,-1.39,;4.33,1.69,;4.33,3.23,;5.79,3.7,;6.7,2.46,;8.23,2.3,;8.86,.89,;10.34,.49,;7.95,-.36,;6.42,-.2,;5.79,1.21,;-5.01,-.62,;-5.01,.92,;-6.34,-1.39,;-6.34,-2.93,;-7.68,-3.7,;-9.01,-2.93,;-10.34,-3.7,;-9.01,-1.39,;-7.68,-.62,)|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@@H]1CC[C@H](O)CC1 |r,wU:23.25,26.29,(-2.34,-3.7,;-3.67,-2.93,;-3.67,-1.39,;-2.34,-.62,;-1.01,-1.39,;.33,-.62,;.33,.92,;1.66,1.69,;2.99,.92,;2.99,-.62,;1.66,-1.39,;4.33,1.69,;4.33,3.23,;5.79,3.7,;6.7,2.46,;8.23,2.3,;8.86,.89,;10.34,.49,;7.95,-.36,;6.42,-.2,;5.79,1.21,;-5.01,-.62,;-5.01,.92,;-6.34,-1.39,;-7.68,-.62,;-9.01,-1.39,;-9.01,-2.93,;-10.34,-3.7,;-7.68,-3.7,;-6.34,-2.93,)|
CCN(CCN1CCC(CC1)c1noc2ccc(F)cc12)C(=O)[C@H](C)O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CC(O)C1 |(-2.73,-3.7,;-4.07,-2.93,;-4.07,-1.39,;-2.73,-.62,;-1.4,-1.39,;-.06,-.62,;-.06,.92,;1.27,1.69,;2.6,.92,;2.6,-.62,;1.27,-1.39,;3.94,1.69,;3.94,3.23,;5.4,3.7,;6.31,2.46,;7.84,2.3,;8.46,.89,;9.95,.49,;7.56,-.36,;6.03,-.2,;5.4,1.21,;-5.4,-.62,;-5.4,.92,;-6.73,-1.39,;-8.22,-.99,;-8.62,-2.48,;-9.95,-3.25,;-7.13,-2.88,)|
CCN(CCN1CCC(CC1)c1c[nH]c2ccccc12)C(=O)CCO
CCN(CCN1CCC(CC1)c1c[nH]c2cc(F)ccc12)C(=O)CCO
CCN(CCN1CCC(CC1)c1c[nH]c2ccccc12)C(=O)[C@@H](C)O |r|
CCN(CCN1CCC(CC1)n1ccc2cc(F)ccc12)C(=O)C(C)O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)S(=O)(=O)C(C)CO
CCN(CCCN1CCC(CC1)c1noc2cc(F)ccc12)S(=O)(=O)CCO
CCN(CCCN1CCC(CC1)c1noc2ccccc12)S(=O)(=O)C(C)CO
CCN(CCCN1CCN(CC1)c1noc2cc(F)ccc12)S(=O)(=O)C(C)CO
CCN(CCCN1CCC(CC1)c1noc2cc(F)ccc12)S(=O)(=O)C(C)CO
CCN(CCN1CCC(CC1)c1c[nH]c2ccccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1noc2cc(F)c(C)cc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1noc2ccc(C)cc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1noc2cc(Cl)ccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1noc2ccccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)c1c[nH]c2cc(F)ccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)n1ncc2cc(F)ccc12)S(=O)(=O)CCO
CCN(CCN1CCC(CC1)n1ncc2cc(F)ccc12)S(=O)(=O)C(C)CO
CCN(CCN1CCC(CC1)C1NOc2cc(F)ccc12)C(=O)C(O)CN
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CNCC1O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CNCCC1O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)[C@H]1NCC[C@H]1O |r|
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1(O)CCCNC1
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1(O)CCNC1
CCN(CCN1CCC(CC1)C1NOc2cc(F)ccc12)C(=O)C(O)CNC(C)=O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1(O)CCCN(C1)C(C)=O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CN(CC1O)C(C)=O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CN(CCC1O)C(C)=O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CN(C)CC1O
CCN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C1CN(C)CCC1O
CN(C)CCc1c[nH]c2cccc(F)c12
COc1cccc2[nH]cc(CCN(C)C)c12
CC(C)CCc1c[nH]c2cccc(OP(O)(O)=O)c12
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(Cl)cc2)C2CCN(C)CC2)cc1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCNC[C@@H]2F)cc1 |r|
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCN(C)C[C@@H]2F)cc1 |r|
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCNC[C@@H]2F)cc1 |r|
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCN(C)C[C@@H]2F)cc1 |r|
CC(C)COc1ccc(OC(=O)N(Cc2ccc(F)cc2)[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(OC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCNC[C@@H]2F)cc1 |r|
CC(C)COc1ccc(OC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)COc1ccc(OC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCN(C)C[C@@H]2F)cc1 |r|
CC(C)COc1ccc(CCOC(=O)N(Cc2ccc(F)cc2)[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(CCOC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCNC[C@@H]2F)cc1 |r|
CC(C)COc1ccc(CCOC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)COc1ccc(CCOC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCN(C)C[C@@H]2F)cc1 |r|
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCNCC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
COc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
COc1ccc(CSC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(cc1)C(OC(=O)N(Cc1ccc(F)cc1)C1CCN(C)CC1)C(F)(F)F
CC(C)Oc1ccc(COC(=O)Oc2ccc(cc2)[N+]([O-])=O)cc1
CC(C)Oc1ccc(CC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)c(F)c1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1F
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CCOc1ccc(CC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CCCCOc1ccc(CC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OCC=C)cc1
CCOc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OCCCF)cc1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;F;;$|
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OC(CF)CF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OCC(C)(C)O)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OC2CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(Cl)cc2F)C2CCN(C)CC2)cc1
COc1cc(F)c(F)cc1CN(C1CCN(C)CC1)C(=O)Cc1ccc(OC(C)C)cc1
COc1cc(F)c(CN(C2CCN(C)CC2)C(=O)Cc2ccc(OCC(C)C)cc2)c(F)c1
CC(C)Oc1ccc(CC(=O)N(Cc2ccc(F)c(F)c2F)C2CCN(C)CC2)cc1
COc1cc(F)c(F)cc1CN(C1CCN(C)CC1)C(=O)OCc1ccc(OCC(C)C)cc1
COc1cc(F)c(CN(C2CCN(C)CC2)C(=O)OCc2ccc(OCC(C)C)cc2)c(F)c1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)c(F)c2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(Cl)cc2F)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OCCF)cc1
CCCCOc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CCc1ccc(CN(C2CCN(C)CC2)C(=O)OCc2ccc(OC(C)C)cc2)c(F)c1
COC(=O)C(C)(C)CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OC(C)C)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(CC(C)(C)C(O)=O)CC2)cc1
CCN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OC(C)C)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(CC2)C2CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2F)C2CCN(CC2)C2COC2)cc1
COc1ccc(CN(C2CCN(C)CC2)C(=O)Cc2ccc(OCC(C)C)cc2)c(F)c1
CC(C)Oc1ccc(\C=C\C(=O)N(Cc2ccc(F)cc2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(CC(=O)N(Cc2ccc(F)cc2F)[C@@H]2CCN(C)C[C@@H]2F)cc1 |r|
CC(C)COc1ccc(CC(=O)N(Cc2ccc(Cl)cc2C(F)(F)F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2OC(F)(F)F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2C)C2CCN(C)CC2)cc1
COc1ccc(CN(C2CCN(C)CC2)C(=O)Cc2ccc(OCC(C)C)cc2)c(Cl)c1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(Cl)cc2C(F)(F)F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2OC(F)(F)F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2C)C2CCN(C)CC2)cc1
COc1ccc(CN(C2CCN(C)CC2)C(=O)OCc2ccc(OC(C)C)cc2)c(Cl)c1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2Cl)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(Cl)cc2Cl)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(CC(=O)N(Cc2ccc(Cl)cc2Cl)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(F)cc2Cl)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(CC(=O)N(Cc2ccc(F)cc2Cl)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2Cl)C2CCN(C)CC2)cc1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(Cl)cc2Cl)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2c(F)ccc(C)c2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2c(F)ccc(F)c2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)c(C)c2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(C)cc2F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CC(=O)N(Cc2ccc(cc2F)C(F)(F)F)C2CCN(C)CC2)cc1
COc1cc(ccc1CN(C1CCN(C)CC1)C(=O)Cc1ccc(OCC(C)C)cc1)C(F)(F)F
CC(C)COc1ccc(CC(=O)N(Cc2ccc(cc2Cl)C(F)(F)F)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(OC(C)(C)C)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)OCc1ccc(cc1)C(C)(F)F
CC(C)Oc1ccc(COC(=O)N(Cc2c(F)cc(Cl)cc2F)C2CCN(C)CC2)cc1
COc1cc(CN(C2CCN(C)CC2)C(=O)OCc2ccc(OC(C)C)cc2)ccc1Cl
COc1cc(Cl)ccc1CN(C1CCN(C)CC1)C(=O)OCc1ccc(OC(C)C)cc1
COc1cc(ccc1CN(C1CCN(C)CC1)C(=O)OCc1ccc(OC(C)C)cc1)C(F)(F)F
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(cc2Cl)C(F)(F)F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(cc2F)C(F)(F)F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2cc(F)c(F)cc2F)C2CCN(C)CC2)cc1
CC(C)Oc1ccc(COC(=O)N(Cc2ccc(F)cc2C(F)(F)F)C2CCN(C)CC2)cc1
CC(C)COc1ccc(COC(=O)N(Cc2ccc(F)cc2O)C2CCN(C)CC2)cc1
CN1CCC[C@@H]1Cc1c[nH]c2cccc(F)c12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2cccc(Cl)c12 |r|
COc1cccc2[nH]cc(C[C@H]3CCCN3C)c12 |r|
Fc1cccc2[nH]cc(C[C@H]3CCCN3)c12 |r|
CN1CCC[C@H]1Cc1c[nH]c2cccc(F)c12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2cccc(OCc3ccccc3)c12 |r,$;;;;;;;;;;;;;;;O;;;;;;;;$|
CN1CCC[C@@H]1Cc1c[nH]c2cccc(O)c12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2cccc(OCc3ccccc3)c12 |r|
Oc1cccc2[nH]cc(C[C@H]3CCCN3)c12 |r|
CCCC\C=C/C\C=C/CCCCCCCC(=O)Oc1cccc2[nH]cc(C[C@H]3CCCN3C)c12 |r|
CCCCC\C=C/C\C=C/CCCCCCCC(=O)Oc1cccc2[nH]cc(C[C@H]3CCCN3C)c12 |r|
Oc1cccc2[nH]cc(C[C@@H]3CCCN3)c12 |r|
CN1CCC[C@H]1Cc1c[nH]c2cccc(OCc3ccccc3)c12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2cccc(OP(O)(O)=O)c12 |r|
Cc1cnc2C(=O)N(CCN3CCN(CC3)c3noc4ccccc34)CCc2c1
O=C1N(CCN2CCC(CC2)c2noc3ccccc23)CCc2ccncc12
Cc1cc2c(cn1)C(=O)N(CCN1CCC(CC1)c1noc3ccccc13)CC21CC1
Cn1nc(Br)c2c1CCN(CCN1CCN(CC1)c1nsc3ccccc13)C2=O
Cc1ccc2c(noc2c1)C1CCN(CCn2ccc3cccnc3c2=O)CC1
COc1ncc2C(=O)N(CCN3CCN(CC3)c3noc4ccccc34)CCc2n1
COc1ccc2CCN(CCN3CCN(CC3)c3noc4ccccc34)C(=O)c2n1
COc1ccc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2n1
COc1ccc(CCc2ccccc2OCC(CN(C)C)OC(=O)CCC(O)=O)cc1
COc1ccc(CCc2ccccc2OC[C@@H](CN(C)C)OC(=O)CCC(O)=O)cc1 |r|
COc1ccc(CCc2ccccc2OC[C@H](CN(C)C)OC(=O)CCC(O)=O)cc1 |r|
COc1cccc(CCc2ccccc2OC[C@@H](O)CN(C)C)c1 |r|
COc1cccc(CCc2ccccc2OC[C@H](O)CN(C)C)c1 |r|
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N(C)CCc1c[nH]c2ccccc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N(C)CCc1c[nH]c2ccc(OC)cc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCCC1Cc1c[nH]c2ccccc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCCC1Cc1c[nH]c2ccc(OC)cc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCC(C1)c1c[nH]c2ccc(OC)cc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCC(C1)c1c[nH]c2ccccc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCC(CC1)c1c[nH]c2ccccc12
CCCCC\C=C/C\C=C/CCCCCCCC(=O)N1CCC(CC1)c1c[nH]c2ccc(OC)cc12
CN(C)[C@H]1C[C@@H](c2cccc(Br)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(Br)c2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(Cl)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(Cl)c2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2cccs2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2cccs2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2cccs2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2cccs2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccco2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccco2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccco2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccco2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccncc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccncc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccncc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccncc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccccc2F)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccccc2F)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccccc2F)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccccc2F)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2cccc(F)c2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccc(F)cc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccc(F)cc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccc(F)cc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccc(F)cc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccc(Cl)cc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccc(Cl)cc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccc(cc2)N(C)C)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccc(cc2)N(C)C)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@@H](c2cccc(c2)-c2ccc(cc2)N(C)C)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@H](c2cccc(c2)-c2ccc(cc2)N(C)C)c2ccccc2C1 |r|
CNCc1cc(OCc2ccccc2)n(Cc2ccccc2)n1
CNCc1cc(OCc2ccccc2)n(CC2CCCCC2)n1
CNCc1cc(OCc2ccccc2F)n(CC2CCCCC2)n1
CNCc1cc(OCc2ccc(F)cc2Cl)n(CC2CCCCC2)n1
CNCc1cc(OCc2ccc(F)cc2C)n(CC2CCCCC2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CC2CCCCC2)n1
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC2CCCCC2)n1
CNCc1cc(OCc2cc(F)ccc2Cl)n(CC2CCCCC2)n1
CNCc1cc(OCc2cc(Cl)ccc2Cl)n(CC2CCCCC2)n1
CNCc1cc(OCc2ccc(F)cc2C)n(CC2CCCCO2)n1
CNCc1cc(OCc2ccccc2)n(CC2CC3CCC2C3)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CC2CC3CCC2C3)n1 |TLB:17:18:21.22:24|
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC2CC3CCC2C3)n1 |TLB:17:18:21.22:24|
CNCc1cc(OCc2cc(F)ccc2F)n(CC2CCC(F)(F)CC2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CC2(F)CCCCC2)n1
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC2CC2)n1
CNCc1cc(OCc2ccc(F)cc2)n(CC2CCCC2)n1
CNCc1cc(OCc2ccccc2Cl)n(CC2CCCC2)n1
CNCc1cc(OCc2ccc(F)cc2F)n(CC2CCCC2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CC2CCCC2)n1
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC2CCCC2)n1
CNCc1cc(OCc2ccccc2C#N)n(CC2CCCC2)n1
CNCc1cc(OCc2ccccc2F)n(Cc2ccc(F)cc2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(Cc2ccc(F)cc2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(Cc2ccc(Cl)cc2)n1
CNCc1cc(OCc2cc(F)ccc2F)n(Cc2ccc(C)cc2)n1
CCCCn1nc(CNC)cc1OCc1cc(F)ccc1F
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC(C)C)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CC(C)(C)C)n1
CNCc1cc(OCc2cc(Cl)ccc2F)n(CC(C)(C)C)n1
CCC(CC)Cn1nc(CNC)cc1OCc1cc(Cl)ccc1F
CNCc1cc(OCc2cc(F)ccc2F)n(CCC(C)(C)C)n1
CNCc1cc(OCc2cc(F)ccc2F)n(CCC(C)C)n1
CNCc1cc(OCc2cc(Cl)ccc2F)n(CCC(C)(C)CO)n1
CNCc1cc(OCc2cc(F)c(F)cc2F)n(CC2CCCC2)n1
CNCc1cc(OCc2cc(F)c(F)cc2F)n(CCC(C)C)n1
CNCc1cc(OCc2cc(F)c(F)cc2F)n(CCC(C)(C)C)n1
CNCc1cc(OCc2cc(F)c(F)cc2F)n(Cc2ccc(C)cc2)n1
CNCc1cc(OCc2ccccc2)n(n1)C(C)C1CCCC1
CNCc1cc(OCc2cc(Cl)ccc2F)n(n1)C(C)C1CCCC1
CNCc1cc(OCc2ccccc2)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2ccccc2F)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2ccc(F)cc2)n(n1)C(C)C1CCCCC1
CNCc1cc(OCC2CC=CC=C2Cl)n(n1)C(C)C1CCCCC1 |c:10,12|
CNCc1cc(OCc2ccccc2C)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2cccc(C)c2)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2ccc(F)cc2F)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2ccc(F)cc2Cl)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2ccc(F)cc2C)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2cc(F)ccc2F)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2cc(Cl)ccc2F)n(n1)C(C)C1CCCCC1
CNCc1cc(OCc2cc(C)ccc2F)n(n1)C(C)C1CCCCC1
CNC(C)c1cc(OCc2cc(F)ccc2F)n(CCC2CCCC2)n1
CNCc1cc(OCc2ccccc2)n(n1)C(CF)C1CCCCC1
CNCc1cc(OCc2ccccc2)n(CC2(C)CCCCC2)n1
CNCc1cc(OCc2cccc(Cl)c2)n(CC2CCc3ccccc3O2)n1
Fc1ccc(F)c(COc2cc(CNC3CC3)nn2CC2CCCCC2)c1
CCNCc1cc(OCc2cc(F)ccc2F)n(CC2CCCCC2)n1
NCc1cc(OCc2cc(F)ccc2F)n(CC2CCCC2)n1
CNCc1cc(OC(F)(F)c2ccccc2)n(CC2CCCCC2)n1
CNCc1nn(CC2CCCCC2)c(OCc2cc(F)ccc2F)c1F
CN(Cc1cc(OCc2cc(F)ccc2F)n(CC2CCCC2)n1)C(=O)OC(C)(C)C
CNCc1cc(OCc2cccc(Cl)c2)n(CC2OC3CCC2CC3)n1 |(5.26,-3.43,;3.8,-2.95,;3.48,-1.44,;2.01,-.97,;1.54,.5,;-0,.5,;-.77,1.83,;-2.31,1.83,;-3.08,3.16,;-2.31,4.5,;-3.08,5.83,;-4.62,5.83,;-5.39,4.5,;-6.93,4.5,;-4.62,3.16,;-.48,-.97,;-1.96,-1.37,;-2.36,-2.86,;-1.27,-3.94,;-1.67,-5.43,;-3.16,-5.83,;-4.25,-4.74,;-3.85,-3.25,;-3.45,-4.74,;-2.12,-3.97,;.77,-1.87,)|
CCCCC\C=C/C\C=C/CCCCCCCC(=O)Oc1cccc2[nH]cc(CCN(C)C)c12
CN(C)CCc1c[nH]c2cccc(OCc3ccccc3)c12
COc1cc(c(OC)cc1C1CCCNC1)C(F)(F)F
COc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1-c1c(Br)cnn1C |(5.14,-.34,;6.47,-1.11,;7.8,-.34,;7.8,1.19,;9.14,1.96,;10.47,1.19,;11.8,1.96,;13.14,1.19,;13.14,-.34,;14.47,1.96,;15.8,1.19,;17.14,1.96,;18.47,1.19,;18.47,-.34,;17.14,-1.11,;17.14,-2.65,;15.8,-.34,;10.47,-.34,;9.14,-1.11,;9.14,-2.65,;10.38,-3.56,;11.85,-3.08,;9.91,-5.02,;8.37,-5.02,;7.89,-3.56,;6.43,-3.08,)|
CC(C)Oc1ccc(NC(=O)Nc2ccc(F)cc2)cc1-c1c(Br)cnn1C |(9.14,8.12,;9.14,6.58,;10.47,5.81,;7.8,5.81,;6.47,6.58,;6.47,8.12,;5.14,8.89,;3.8,8.12,;2.47,8.89,;2.47,10.43,;1.13,11.2,;3.8,11.2,;3.8,12.74,;2.47,13.51,;2.47,15.05,;3.8,15.82,;3.8,17.36,;5.14,15.05,;5.14,13.51,;3.8,6.58,;5.14,5.81,;5.14,4.27,;6.38,3.37,;7.85,3.85,;5.91,1.9,;4.37,1.9,;3.89,3.37,;2.42,3.85,)|
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCc1ccccc1 |(3.76,-3.08,;5.22,-3.56,;5.7,-5.02,;7.24,-5.02,;7.71,-3.56,;9.18,-3.08,;6.47,-2.65,;6.47,-1.11,;5.14,-.34,;5.14,1.19,;3.8,1.96,;2.47,1.19,;2.47,-.34,;1.13,1.96,;-.2,1.19,;-.2,-.34,;-1.53,-1.11,;-2.87,-.34,;-4.2,-1.11,;-2.87,1.19,;-1.53,1.96,;6.47,1.96,;7.8,1.19,;7.8,-.34,;9.14,-1.11,;10.47,-.34,;11.8,-1.11,;13.14,-.34,;14.47,-1.11,;14.47,-2.65,;13.14,-3.42,;11.8,-2.65,)|
COc1ccc(NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1-c1c(Cl)cnn1C |(2.47,-.34,;3.8,-1.11,;5.14,-.34,;5.14,1.19,;6.47,1.96,;7.8,1.19,;9.14,1.96,;10.47,1.19,;11.8,1.96,;10.47,-.34,;11.8,-1.11,;13.14,-.34,;14.47,-1.11,;14.47,-2.65,;15.8,-3.42,;13.14,-3.42,;11.8,-2.65,;10.47,-3.42,;9.14,-4.19,;9.7,-2.09,;11.24,-4.76,;7.8,-.34,;6.47,-1.11,;6.47,-2.65,;7.71,-3.56,;9.18,-3.08,;7.24,-5.02,;5.7,-5.02,;5.22,-3.56,;3.76,-3.08,)|
COc1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1-c1c(F)cnn1C |(5.14,-.34,;6.47,-1.11,;7.8,-.34,;7.8,1.19,;9.14,1.96,;10.47,1.19,;11.8,1.96,;13.14,1.19,;13.14,-.34,;14.47,1.96,;15.8,1.19,;17.14,1.96,;18.47,1.19,;18.47,-.34,;19.81,-1.11,;17.14,-1.11,;15.8,-.34,;17.14,-2.65,;17.14,-4.19,;15.6,-2.65,;18.68,-2.65,;10.47,-.34,;9.14,-1.11,;9.14,-2.65,;10.38,-3.56,;11.85,-3.08,;9.91,-5.02,;8.37,-5.02,;7.89,-3.56,;6.43,-3.08,)|
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(O)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ncc(F)cn2)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ncc(F)cn2)C2CCN(CCCN(C)C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OC(C)(C)C)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)nc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cn1
CC(C)OCc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1
CC1(C)Cc2cc(CNC(=O)N(Cc3ccc(F)cn3)C3CCNCC3)ccc2O1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OC(C)(C)Cc2c1
CC(C)C(O)Cc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)c(F)c1
CC(C)N1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc2OC(C)(C)Cc2c1
CC(C)OCc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OC(F)(F)C(F)(F)F)cc1
CC(C)C1Cc2cc(CNC(=O)N(Cc3ccc(F)cn3)C3CCN(C)CC3)ccc2O1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OC(CF)CF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OCCc2c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(C)(C)F)cc1
CCN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OC(C)(C)Cc2c1
CCOc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)cc1
CC(C)c1cc2cc(CNC(=O)N(Cc3ccc(F)cn3)C3CCN(C)CC3)ccc2o1
CC(C)CCc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCCF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCC(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ncc(F)cc1F)C(=O)NCc1ccc2OC(C)(C)Cc2c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCCCF)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(CC3CCCCC3)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)c(Br)c1
CCN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1cc2CC(C)(C)Oc2c(Cl)c1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)NCc1ccc(OCC(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)NCc1ccc(OCCF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1F)C(=O)NCc1ccc2OC(C)(C)Cc2c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1cc2CC(C)(C)Oc2c(Br)c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)F)cc1
CN1CCC(CC1)N(Cc1ncc(F)cc1F)C(=O)NCc1ccc(OC(C)(C)C)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCCC(F)(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OC(Cc2c1)C(F)(F)F
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)nn2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCC(F)F)cc1
CN1CCC(CC1)N(Cc1ncc(F)cc1F)C(=O)NCc1ccc(OCCC(F)F)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCCC(F)F)cc1
CN1CCC(CC1)N(Cc1ncc(F)cc1F)C(=O)NCc1ccc(OCCCC(F)F)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)nc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OC(C)(C)CCc2c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc2OC(C)(C)C=Cc2c1 |c:30|
Cc1ccc2cccc(NC(=O)c3ccc(cc3)C(C)(C)C)c2n1
Fc1cccc(c1)C(=O)Nc1cccc2cccnc12
COc1ccc(cc1)C(=O)Nc1cccc2ccc(C)nc12
CCOc1ccccc1C(=O)Nc1cccc2ccc(C)nc12
CC(C)Oc1ccc(cc1)C(=O)Nc1cccc2cccnc12
CC(C)Oc1ccc(cc1)C(=O)Nc1cccc2ccc(C)nc12
CC(C)Oc1cccc(c1)C(=O)Nc1cccc2ccc(C)nc12
Cc1ccc(C(=O)Nc2cccc3ccc(C)nc23)c(Cl)c1
COc1c(C)cccc1C(=O)Nc1cccc2ccc(C)nc12
COc1ccc(CCC(=O)Nc2cccc3ccc(C)nc23)cc1
Cc1ccc2cccc(NC(=O)c3ccc(Br)s3)c2n1
Cc1ccc2cccc(NC(=O)c3cc4ccccc4s3)c2n1
O=C(Nc1cccc2cccnc12)c1cccc(c1)C#N
Cc1ccc2cccc(NC(=O)c3ccccc3C(F)(F)F)c2n1
CN1CCC(C1)c1c[nH]c2cccc(OCc3ccccc3)c12
CN1CCC(C1)c1c[nH]c2cccc(O)c12
CN1CCC(C1)c1c[nH]c2cccc(F)c12
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(Oc2ccccc2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)N[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)CC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc2OCCc2c1
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(cc1)C1CC1
CC(C)CNc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(C)cn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cc3ccccc3o2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(OC(F)(F)F)cc1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C(=O)OC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C(=O)NC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2cnn(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1 |r|
CN1CCC(CC1)NC(=O)N(Cc1coc(C)n1)Cc1ccc(CCC(F)(F)F)cc1F
CCCc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CCCCOc1ccc(CN(Cc2coc(n2)C(F)F)C(=O)NC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2coc(n2)C2CC2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
CN1CCC(CC1)NC(=O)N(Cc1cnn(C)n1)Cc1ccc(OCC(F)(F)C(F)(F)F)cc1F
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)CC2CCN(C)CC2)cc1F
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)CN2CCN(C)CC2)cc1F
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccsc2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cc(C)n(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccccn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(C)s2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cccn2C)C(=O)NC2CCN(C)CC2)cc1
COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)cc1C
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(OCCO)cc1
COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)NC2CCNCC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccncn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cnccn2)C(=O)NC2CCN(C)CC2)cc1
CCCOc1ccc(CN(Cc2ccc(F)cn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)N[C@@H]2CCNC[C@@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ncccc2C)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccco2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2nccs2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc2OCOc2c1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2CCNCC2(F)F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2CCNCC22CC2)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccc(cn2)C#N)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cccs2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cocn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)CN2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(C)cc1
CC(C)COc1ccc(CN(Cc2cc(C)on2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)c2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2nn(C)cc2Cl)C(=O)NC2CCN(C)CC2)cc1
COc1ccc(CN(Cc2ccc(F)cn2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)NC2CCN(C)CC22CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC22CC2)cc1
CC(C)Oc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)N[C@H]2CCN(C)C[C@H]2F)cc1 |r|
COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)CC2)nc1
CC(C)COc1ccc(CN(Cc2ccncc2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccnn2C)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)C2)cc1
CC(C)COc1ccc(CN(Cc2cc(-c3ccccc3)n(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cc(ccn2)C(F)(F)F)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cccnc2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2[C@H]3CN(C)C[C@@H]23)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NCC2CN(C)C2)cc1
CC(C)COc1ccc(CN(Cc2cnn(C)c2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CC3CC2CN3C)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2C[C@@H]3CC[C@H](C2)N3C)cc1 |r,TLB:29:28:24.25:21.22.27|
COCCN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(OCC(C)C)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2CCN(C)C[C@@H]2C)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2CCN(C)C[C@H]2C)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2(C)CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(C)C3(CCC3)C2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC23CCN(CC2)CC3)cc1
CCN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(OCC(C)C)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(CC2)C2COC2)cc1
CNC(=O)CN1CCC(CC1)NC(=O)N(Cc1ccn(C)n1)Cc1ccc(OCC(C)C)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@@H]2C[C@@H]3CCC[C@H](C2)N3C)cc1 |r,TLB:30:29:21.28.22:26.24.25|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)N[C@H]2C[C@@H]3CCC[C@H](C2)N3C)cc1 |r,TLB:30:29:21.28.22:26.24.25|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2C3CCC2CN(C)C3)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCN(CC3CCC3)CC2)cc1
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)N[C@H]2CCN(C)C[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)NC2CCNCC2)cc1
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)N[C@H]2CCNC[C@H]2F)cc1 |r|
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)OC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C(=O)OC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2cc(C)n(C)n2)C(=O)OC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(C)[nH]2)C(=O)OC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CN1CCC(CC1)NC(=O)N(Cc1coc(C)n1)Cc1ccc(OCC(F)(F)C(F)(F)F)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1 |r|
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1F |r|
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)c(F)c1 |r|
CC(C)COc1ccc(CN(Cc2ccn(C)c2)C(=O)OC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C(=O)OC2CCN(C)CC2)cc1
COc1ccc(CN(Cc2ccn(C)c2)C(=O)OC2CCN(C)CC2)cc1
COc1ccc(CN(Cc2coc(C)n2)C(=O)OC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2cnn(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1F |r|
CCCCOc1ccc(CN(Cc2cnn(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)c(F)c1 |r|
CCCCOc1ccc(CN(Cc2cnn(C)n2)C(=O)N[C@H]2CCN(C)CC22CC2)cc1 |r|
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)CC2CCN(C)CC2)cc1
CCCCOc1ccc(CN(Cc2cnn(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CN1CCC(CC1)NC(=O)N(Cc1coc(C)n1)Cc1ccc(CCC(F)(F)F)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)CN2CCN(C)CC2)cc1
CCCc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1coc(n1)C1CC1)Cc1ccc(OCC(F)(F)F)cc1
CN1CCC(CC1)NC(=O)N(Cc1coc(n1)C1CC1)Cc1ccc(OCC(F)(F)F)cc1F
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
CCCc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)c(F)c1
CC(C)COc1ccc(CN(Cc2coc(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C(=O)NC2CCN(C)CC2)cc1F
CCCCOc1ccc(CN(Cc2coc(CF)n2)C(=O)NC2CCN(C)CC2)cc1
CC(C)COc1ccc(CN(Cc2coc(CF)n2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)N(Cc1coc(C)n1)Cc1ccc(OCC(F)(F)C(F)(F)F)cc1F
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)C(F)C2CCN(C)CC2)cc1F
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)C[C@H]2[C@@H]3CNC[C@H]23)cc1F |r|
CCCCOc1ccc(CN(Cc2coc(C)n2)C(=O)CCC2CCNCC2)cc1F
COc1cc(c(OC)cc1CC(C)N)C(F)(F)F
COc1cc(c(cc1C#N)OC)CCNCc2ccccc2O
COc1cc(CC(C)N)c(OC)cc1CCCCF
CCCCSc1cc(OC)c(CC(C)N)cc1OC
CCCCCSc1cc(OC)c(CC(C)N)cc1OC
CCCCCSc1cc(OC)c(C[C@H](C)N)cc1OC |r|
CCCCCSc1cc(OC)c(C[C@@H](C)N)cc1OC |r|
CCCCCCCc1cc(OC)c(CC(C)N)cc1OC
CCCCCc1c(OC)cc(CCN)cc1OC
CCCCSc1c(OC)cc(CCN)cc1OC
CCCCSc1c(OC)cc(CCNCc2ccccc2OC)cc1OC
CCCCCc1c(OC)cc(CC(C)N)cc1OC
CCCCSc1c(OC)cc(CC(C)N)cc1OC
CCCCCc1cc(OC)c(CCNCc2ccccc2OC)cc1OC
CCCCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC
COc1cc(CCNCc2ccccc2)c(OC)cc1C
COc1cc(CCNCc2ccccc2F)c(OC)cc1C
COc1ccccc1CNC(C)Cc1cc(OC)c(C)cc1OC
COc1cc(CC(C)NCc2ccccc2O)c(OC)cc1C
CCC(Cc1cc(OC)c(C)cc1OC)NCc1ccccc1OC
COc1ccccc1CCC(C)Cc1cc(OC)c(cc1OC)C#N
COc1cc(C#N)c(OC)cc1CC(C)NCc1ccccc1O
COc1cc(Sc2ccccc2)c(OC)cc1CC(C)N
COc1cc(CC(C)NC(=O)OCc2ccccc2)c(OC)cc1CCCCCF
COc1cc(\C=C\CC(C)C)c(OC)cc1CC(C)NC(=O)OCc1ccccc1
COc1cc(CC(C)NC(=O)OCc2ccccc2)c(OC)cc1CCCC(F)(F)F
CCCCOc1cc(OC)c(CC(C)N)cc1OC
COCCCc1cc(OC)c(CC(C)N)cc1OC
COc1cc(CCCCF)c(OC)cc1CCN
CCCCSc1cc(OC)c(CCN)cc1OC
CCCCCSc1cc(OC)c(CCN)cc1OC
CCCCCCc1cc(OC)c(CC(N)CC)cc1OC
CCCCSc1cc(OC)c(CC(N)CC)cc1OC
CCC(N)Cc1cc(OC)c(CCCCF)cc1OC
CCCCCc1cc(OC)c(CC(N)CO)cc1OC
CCCCCSc1c(OC)cc(CCN)cc1OC
COc1cc(CCN)cc(OC)c1SCCCC(C)C
COc1cc(CCN)cc(OC)c1SCCC(C)C
COc1cc(CCN)cc(OC)c1SCCCCF
COc1cc(CCN)cc(OC)c1SCCCCO
CCCCSc1c(OC)cc(CC(N)CC)cc1OC
CCCCCc1c(OC)cc(CCNCc2ccccc2OC)cc1OC
CCCCSc1c(OC)cc(CCNCc2ccccc2O)cc1OC
CCCCCSc1c(OC)cc(CCNCc2ccccc2OC)cc1OC
CCCCSc1c(OC)cc(CC(C)NCc2ccccc2OC)cc1OC
CCCCCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC
CCCCSc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC
CCCCCc1cc(OC)c(CC(C)NCc2ccccc2O)cc1OC
CCCCCc1cc(OC)c(CC(CC)NCc2ccccc2OC)cc1OC
CCCc1cc(OC)c(CCNCc2ccccc2)cc1OC
CCCc1cc(OC)c(CCNCc2ccccc2F)cc1OC
COc1cc(C#N)c(OC)cc1CCNCc1ccccc1
COc1cc(C#N)c(OC)cc1CC(C)NCc1cccc2OCOc12
CCCc1cc(OC)c(CC(C)NCc2ccccc2OC)cc1OC
CCCc1cc(OC)c(CC(CC)NCc2ccccc2OC)cc1OC
CCCCSc1c(OC)cc(CCN)c(C)c1OC
CCCCSc1c(OC)cc(CCN)c(Br)c1OC
CCCCCc1c(C)c(OC)c(\C=C(/C)N)cc1OC
CCCc1ccc(CC(C)N)c(OC)c1
CCCc1ccc(CCN)c(OC)c1
CCSc1ccc(CC(C)N)c(OC)c1
CCCCCc1ccc(CC(C)N)c(OC)c1
COc1cc(CC(C)N)c(OC)cc1CCCCCCF
COc1cc(CC(C)N)c(OC)cc1CCCCC(F)(F)F
CCC(N)Cc1cc(OC)c(SCCCCCF)cc1OC
CCC(N)Cc1cc(OC)c(SCCCCC(F)(F)F)cc1OC
CCC(N)Cc1cc(OC)c(CCCCCCF)cc1OC
CCC(N)Cc1cc(OC)c(CCCC(F)(F)F)cc1OC
CCC(N)Cc1cc(OC)c(CCCCC(F)(F)F)cc1OC
COc1cc(CCN)cc(OC)c1SCCCCCF
COc1cc(CCN)cc(OC)c1SCCCC(F)(F)F
COc1cc(CCN)cc(OC)c1SCCCCC(F)(F)F
CCC(N)Cc1cc(OC)c(SCCCCF)c(OC)c1
CCC(N)Cc1cc(OC)c(SCCCC(F)(F)F)c(OC)c1
COc1cc(SCCCCCF)c(OC)cc1CC(C)N
COc1cc(SCCCCCF)c(OC)cc1CCN
COc1cc(CCCCCCF)c(OC)cc1CCN
CCC(N)Cc1cc(OC)c(CCCCCF)cc1OC
CCOCCc1cc(OC)c(CC(N)CC)cc1OC
CCCOCc1cc(OC)c(CC(N)CC)cc1OC
CCCCCSc1cc(OC)c(CC(N)CC)cc1OC
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2C2CC2)-c2noc(C)n2)ccc1C#N
CN(C)CCOc1cc(NC(=O)c2ccc(cc2)-c2ccc(cc2C2CC2)-c2noc(C)n2)ncc1C#N
CN(C)CCOc1cc(NC(=O)c2ccc(cc2)-c2ccc(cc2Cl)-c2noc(C)n2)ncc1C#N
CN(C)CCOc1nc(NC(=O)c2ccc(cc2)-c2ccc(cc2Cl)-c2noc(C)n2)ncc1C#N
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2C2CC2)-c2noc(C)n2)ncc1Br
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2F)-c2noc(C)n2)ncc1Br
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2Cl)-c2noc(C)n2)ncc1Br
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2C(F)(F)F)-c2noc(C)n2)ncc1Br
COc1cc(ccc1-c1ccc(cn1)C(=O)Nc1cc(OCCN(C)C)c(Br)cn1)-c1noc(C)n1
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2C2CC2)-c2noc(C)n2)ncc1C#N
CN(C)CCOc1cc(NC(=O)c2ccc(nc2)-c2ccc(cc2Cl)-c2noc(C)n2)ncc1C#N
COc1cc(ccc1-c1ccc(cn1)C(=O)Nc1cc(OCCN(C)C)c(cn1)C#N)-c1noc(C)n1
CN(C)CCOc1nc(NC(=O)c2ccc(nc2)-c2ccc(cc2C2CC2)-c2noc(C)n2)ccc1C#N
CN(C)CCOc1cc(ccc1Br)C(=O)Nc1ccc(nc1)-c1ccc(cc1F)-c1noc(C)n1
CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31
Fc1ccc(OCCCN2CC[C@H]3[C@@H](C2)c2cccc4NC(=O)CN3c24)cc1 |r|
Fc1ccc(OCCCN2CC[C@H]3C(C2)c2cccc4NC(=O)CN3c24)cc1 |r|
CN(C)CCc1c[nH]c2ccc(OC(F)(F)F)cc12
CN(C)C(=O)NC1CCC(CC1)CCN2CCN(CC2)c3cccc(c3Cl)Cl
CC(C)(O)C(=O)NC1CC(CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |(-8.28,-4.39,;-8.28,-2.85,;-9.61,-2.08,;-9.61,-3.62,;-6.94,-2.08,;-6.94,-.54,;-5.61,-2.85,;-4.28,-2.08,;-3.88,-.6,;-2.39,-1,;-1.06,-.23,;.28,-1,;1.61,-.23,;1.61,1.31,;2.94,2.08,;4.28,1.31,;4.28,-.23,;2.94,-1,;5.61,2.08,;5.61,3.62,;6.94,4.39,;8.28,3.62,;8.28,2.08,;9.61,1.31,;6.94,1.31,;6.94,-.23,;-2.79,-2.48,)|
OC1(CC1)C(=O)N[C@H]1C[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |r,wU:9.10,wD:7.7,(-8.28,-4.39,;-8.28,-2.85,;-9.61,-2.08,;-9.61,-3.62,;-6.94,-2.08,;-6.94,-.54,;-5.61,-2.85,;-4.28,-2.08,;-2.79,-2.48,;-2.39,-1,;-1.06,-.23,;.28,-1,;1.61,-.23,;1.61,1.31,;2.94,2.08,;4.28,1.31,;4.28,-.23,;2.94,-1,;5.61,2.08,;5.61,3.62,;6.94,4.39,;8.28,3.62,;8.28,2.08,;9.61,1.31,;6.94,1.31,;6.94,-.23,;-3.88,-.6,)|
OC1(CC1)C(=O)N[C@@H]1C[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |r,wD:9.10,7.7,(-8.28,-4.39,;-8.28,-2.85,;-9.61,-2.08,;-9.61,-3.62,;-6.94,-2.08,;-6.94,-.54,;-5.61,-2.85,;-4.28,-2.08,;-3.88,-.6,;-2.39,-1,;-1.06,-.23,;.28,-1,;1.61,-.23,;1.61,1.31,;2.94,2.08,;4.28,1.31,;4.28,-.23,;2.94,-1,;5.61,2.08,;5.61,3.62,;6.94,4.39,;8.28,3.62,;8.28,2.08,;9.61,1.31,;6.94,1.31,;6.94,-.23,;-2.79,-2.48,)|
Clc1cccc(N2CCN(CC[C@H]3C[C@@H](C3)NC(=O)c3nccs3)CC2)c1Cl |r,wU:12.11,wD:14.16,(10.13,1.55,;8.8,2.32,;8.8,3.86,;7.46,4.63,;6.13,3.86,;6.13,2.32,;4.8,1.55,;3.46,2.32,;2.13,1.55,;2.13,.01,;.79,-.76,;-.54,.01,;-1.87,-.76,;-2.27,-2.25,;-3.76,-1.85,;-3.36,-.36,;-5.09,-2.62,;-6.43,-1.85,;-6.43,-.31,;-7.76,-2.62,;-7.76,-4.16,;-9.22,-4.63,;-10.13,-3.39,;-9.22,-2.14,;3.46,-.76,;4.8,.01,;7.46,1.55,;7.46,.01,)|
Clc1cccc(N2CCN(CCC3CC(C3)NS(=O)(=O)C3CC3)CC2)c1Cl |(9.33,1.6,;8,2.37,;8,3.91,;6.66,4.68,;5.33,3.91,;5.33,2.37,;4,1.6,;2.66,2.37,;1.33,1.6,;1.33,.06,;-.01,-.71,;-1.34,.06,;-2.67,-.71,;-4.16,-.32,;-4.56,-1.8,;-3.07,-2.2,;-5.89,-2.57,;-7.23,-1.8,;-8.56,-1.03,;-6.46,-.47,;-8,-3.14,;-9.33,-3.91,;-8,-4.68,;2.66,-.71,;4,.06,;6.66,1.6,;6.66,.06,)|
Clc1cccc(N2CCN(CCC3CC(C3)NC(=O)c3ncco3)CC2)c1Cl |(10.13,1.55,;8.8,2.32,;8.8,3.86,;7.46,4.63,;6.13,3.86,;6.13,2.32,;4.8,1.55,;3.46,2.32,;2.13,1.55,;2.13,.01,;.79,-.76,;-.54,.01,;-1.87,-.76,;-3.36,-.36,;-3.76,-1.85,;-2.27,-2.25,;-5.09,-2.62,;-6.43,-1.85,;-6.43,-.31,;-7.76,-2.62,;-7.76,-4.16,;-9.22,-4.63,;-10.13,-3.39,;-9.22,-2.14,;3.46,-.76,;4.8,.01,;7.46,1.55,;7.46,.01,)|
Cc1cnoc1C(=O)N[C@H]1C[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |r,wU:11.12,wD:9.9,(-9.04,-13.78,;-8.72,-15.28,;-9.75,-16.43,;-8.98,-17.76,;-7.47,-17.44,;-7.31,-15.91,;-5.98,-15.14,;-5.98,-13.6,;-4.64,-15.91,;-3.31,-15.14,;-1.82,-15.54,;-1.42,-14.05,;-.09,-13.28,;1.24,-14.05,;2.58,-13.28,;2.58,-11.74,;3.91,-10.97,;5.24,-11.74,;5.24,-13.28,;3.91,-14.05,;6.58,-10.97,;6.58,-9.43,;7.91,-8.66,;9.25,-9.43,;9.25,-10.97,;10.58,-11.74,;7.91,-11.74,;7.91,-13.28,;-2.91,-13.65,)|
Cc1cc(on1)C(=O)NC1CC(CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |(-10.93,-3.06,;-9.4,-3.22,;-8.37,-2.07,;-6.96,-2.7,;-7.12,-4.23,;-8.63,-4.55,;-5.63,-1.93,;-5.63,-.39,;-4.29,-2.7,;-2.96,-1.93,;-2.56,-.44,;-1.07,-.84,;.26,-.07,;1.59,-.84,;2.93,-.07,;2.93,1.47,;4.26,2.24,;5.59,1.47,;5.59,-.07,;4.26,-.84,;6.93,2.24,;6.93,3.78,;8.26,4.55,;9.6,3.78,;9.6,2.24,;10.93,1.47,;8.26,1.47,;8.26,-.07,;-1.47,-2.33,)|
Clc1cccc(N2CCN(CC[C@H]3C[C@@H](C3)NC(=O)c3ccno3)CC2)c1Cl |r,wU:12.11,wD:14.16,(10.58,-11.74,;9.25,-10.97,;9.25,-9.43,;7.91,-8.66,;6.58,-9.43,;6.58,-10.97,;5.24,-11.74,;3.91,-10.97,;2.58,-11.74,;2.58,-13.28,;1.24,-14.05,;-.09,-13.28,;-1.42,-14.05,;-1.82,-15.54,;-3.31,-15.14,;-2.91,-13.65,;-4.64,-15.91,;-5.98,-15.14,;-5.98,-13.6,;-7.31,-15.91,;-8.72,-15.28,;-9.75,-16.43,;-8.98,-17.76,;-7.47,-17.44,;3.91,-14.05,;5.24,-13.28,;7.91,-11.74,;7.91,-13.28,)|
Cc1ncc(o1)C(=O)NC1CC(CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |(-10.93,-3.06,;-9.4,-3.22,;-8.63,-4.55,;-7.12,-4.23,;-6.96,-2.7,;-8.37,-2.07,;-5.63,-1.93,;-5.63,-.39,;-4.29,-2.7,;-2.96,-1.93,;-2.56,-.44,;-1.07,-.84,;.26,-.07,;1.59,-.84,;2.93,-.07,;2.93,1.47,;4.26,2.24,;5.59,1.47,;5.59,-.07,;4.26,-.84,;6.93,2.24,;6.93,3.78,;8.26,4.55,;9.6,3.78,;9.6,2.24,;10.93,1.47,;8.26,1.47,;8.26,-.07,;-1.47,-2.33,)|
Clc1cccc(N2CCN(CC[C@H]3C[C@@H](C3)NC(=O)c3ccon3)CC2)c1Cl |r,wU:12.11,wD:14.16,(9.85,13.66,;8.52,14.43,;8.52,15.97,;7.18,16.74,;5.85,15.97,;5.85,14.43,;4.52,13.66,;3.18,14.43,;1.85,13.66,;1.85,12.12,;.52,11.35,;-.82,12.12,;-2.15,11.35,;-2.55,9.86,;-4.04,10.26,;-3.64,11.75,;-5.37,9.49,;-6.7,10.26,;-6.7,11.8,;-8.04,9.49,;-9.45,10.12,;-10.48,8.98,;-9.71,7.64,;-8.2,7.96,;3.18,11.35,;4.52,12.12,;7.18,13.66,;7.18,12.12,)|
Cc1nc(co1)C(=O)N[C@H]1C[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |r,wU:11.12,wD:9.9,(-10.28,7.21,;-9.65,8.62,;-8.14,8.94,;-7.98,10.47,;-9.39,11.1,;-10.42,9.95,;-6.65,11.24,;-6.65,12.78,;-5.31,10.47,;-3.98,11.24,;-2.49,10.84,;-2.09,12.33,;-.76,13.1,;.57,12.33,;1.91,13.1,;1.91,14.64,;3.24,15.41,;4.57,14.64,;4.57,13.1,;3.24,12.33,;5.91,15.41,;5.91,16.95,;7.24,17.72,;8.58,16.95,;8.58,15.41,;9.91,14.64,;7.24,14.64,;7.24,13.1,;-3.58,12.73,)|
Clc1cccc(N2CCN(CC[C@H]3C[C@@H](C3)NC(=O)c3cccc4ncccc34)CC2)c1Cl |r,wU:12.11,wD:14.16,(10.49,15.83,;9.16,16.6,;9.16,18.14,;7.82,18.91,;6.49,18.14,;6.49,16.6,;5.16,15.83,;3.82,16.6,;2.49,15.83,;2.49,14.29,;1.15,13.52,;-.18,14.29,;-1.51,13.52,;-1.91,12.03,;-3.4,12.43,;-3,13.92,;-4.73,11.66,;-6.07,12.43,;-6.07,13.97,;-7.4,11.66,;-7.4,10.12,;-8.73,9.35,;-10.07,10.12,;-10.07,11.66,;-11.4,12.43,;-11.4,13.97,;-10.07,14.74,;-8.73,13.97,;-8.73,12.43,;3.82,13.52,;5.16,14.29,;7.82,15.83,;7.82,14.29,)|
CN(C1CC1)C(=O)NC1CC(CCN2CCN(CC2)c2cccc(Cl)c2Cl)C1 |(-7.51,-4.39,;-7.51,-2.85,;-8.84,-2.08,;-10.38,-2.08,;-9.61,-.75,;-6.17,-2.08,;-6.17,-.54,;-4.84,-2.85,;-3.51,-2.08,;-3.11,-.6,;-1.62,-1,;-.29,-.23,;1.05,-1,;2.38,-.23,;3.71,-1,;5.05,-.23,;5.05,1.31,;3.71,2.08,;2.38,1.31,;6.38,2.08,;6.38,3.62,;7.71,4.39,;9.05,3.62,;9.12,2,;10.45,1.21,;7.71,1.31,;7.71,-.23,;-2.02,-2.48,)|
C[C@@H]1CN(CCC2CC(C2)NC(=O)C(C)(C)O)CCN1c1cccc(Cl)c1Cl |r,wU:1.0,(2.94,3.62,;2.94,2.08,;1.61,1.31,;1.61,-.23,;.28,-1,;-1.06,-.23,;-2.39,-1,;-3.88,-.6,;-4.28,-2.08,;-2.79,-2.48,;-5.61,-2.85,;-6.94,-2.08,;-6.94,-.54,;-8.28,-2.85,;-9.61,-2.08,;-8.28,-4.39,;-9.61,-3.62,;2.94,-1,;4.28,-.23,;4.28,1.31,;5.61,2.08,;5.61,3.62,;6.94,4.39,;8.28,3.62,;8.28,2.08,;9.61,1.31,;6.94,1.31,;6.94,-.23,)|
CCN(C)C(=O)NC1CC(CCN2CCN(CC2)c2cccc3sccc23)C1 |(-10.18,-2.85,;-8.85,-2.08,;-7.52,-2.85,;-7.52,-4.39,;-6.18,-2.08,;-6.18,-.54,;-4.85,-2.85,;-3.52,-2.08,;-3.12,-.6,;-1.63,-1,;-.3,-.23,;1.04,-1,;2.37,-.23,;3.7,-1,;5.04,-.23,;5.04,1.31,;3.7,2.08,;2.37,1.31,;6.37,2.08,;6.37,3.62,;7.71,4.39,;9.04,3.62,;9.04,2.08,;10.18,1.05,;9.56,-.35,;8.03,-.19,;7.71,1.31,;-2.03,-2.48,)|
Clc1cccc(N2CCCN(CCC3CC(C3)NC(=O)c3ccco3)CC2)c1Cl |(10.16,-.91,;9.39,.43,;10.16,1.76,;9.39,3.09,;7.85,3.09,;7.08,1.76,;5.54,1.76,;4.87,3.15,;3.37,3.49,;2.17,2.53,;2.17,.99,;.83,.22,;-.5,.99,;-1.84,.22,;-3.32,.62,;-3.72,-.87,;-2.23,-1.27,;-5.05,-1.64,;-6.39,-.87,;-6.39,.67,;-7.72,-1.64,;-9.13,-1.01,;-10.16,-2.16,;-9.39,-3.49,;-7.88,-3.17,;3.37,.03,;4.87,.37,;7.85,.43,;7.08,-.91,)|
[2H]C([2H])([2H])N2C[C@@H](NC(=O)N(CC)OC)C=C1c3cccc4[nH]cc(CC12)c34
[2H]C([2H])([2H])N2C[C@H](NC(=O)N(CC)OC)C=C1c3cccc4[nH]cc(CC12)c34
[2H]C([2H])([2H])N2C[C@@H](NC(=O)N(CC)CC)C=C1c3cccc4[nH]cc(CC12)c34
CCCN(CCC)CCc1c[nH]c2ccc(F)cc12
CCN(CCc1c[nH]c2ccc(F)cc12)C(C)C
CC(C)N(C)CCc1c[nH]c2ccc(F)cc12
CCC(C)N(C)CCc1c[nH]c2ccc(F)cc12
CCCN(CCc1c[nH]c2ccc(F)cc12)C(C)C
CCCN(CC)CCc1c[nH]c2ccc(F)cc12
CCN(C)CCc1c[nH]c2c(F)cccc12
CCN(CC)CCc1c[nH]c2cccc(F)c12
CCCN(CC)CCc1c[nH]c2cc(F)c(F)cc12
CCN(CCc1c[nH]c2ccc(F)cc12)CC=C
CCN(C)CCc1c[nH]c2ccc(F)cc12
CCCN(C)CCc1c[nH]c2ccc(F)cc12
Fc1ccc2[nH]cc(CCN(CC=C)C3CCC3)c2c1
CN1CCC(C1)c1c[nH]c2ccc(F)cc12
CC(C)N(CCc1c[nH]c2ccc(F)cc12)CC=C
CC(C)N(CCc1c[nH]c2ccc(F)cc12)CC#N
CN1CCC(C1)c1c[nH]c2cc(F)c(F)cc12
CCCN(CC)CCc1c[nH]c2ccc(F)c(F)c12
CCCN(CCc1c[nH]c2ccc(F)cc12)C(C)CC
CN1CCC(C1)c1c[nH]c2c(F)cccc12
CN1CCC[C@H]1Cc1c[nH]c2ccc(F)cc12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2ccc(F)cc12 |r|
CN1CC(C1)c1c[nH]c2ccc(F)cc12
CCC(C)N(CC)CCc1c[nH]c2ccc(F)cc12
CCN(CCc1c[nH]c2ccc(F)cc12)C1CCC1
CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C(C)C
CCCN(CCc1c[nH]c2ccc(F)cc12)C1CCC1
CC(C)N(CCc1c[nH]c2ccc(F)cc12)CC#C
CCCN(CCc1c[nH]c2ccc(F)cc12)CC=C
CCCN(CC)CCc1c[nH]c2cc(Cl)c(F)cc12
CC(C)CN(C)CCc1c[nH]c2ccc(F)cc12
CC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CCC1
CCCN(CC)CCc1c[nH]c2c(F)cc(OC)cc12
CN(CCc1c[nH]c2ccc(F)cc12)C1CCC1
CCN(C)CCc1c[nH]c2c(F)cc(F)cc12
CCCN(CC)CCc1c[nH]c2c(F)cc(F)cc12
CCCN(CC)CCc1c[nH]c2c(F)c(F)ccc12
CCN(C)CCc1c[nH]c2c(F)cc(OC)cc12
CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CCC1
CN(CCc1c[nH]c2ccc(F)cc12)C1CC1
CCCN(CCc1c[nH]c2ccc(F)cc12)C1CC1
CCCN(CCc1c[nH]c2c(F)cccc12)C1CCC1
CCCN(CCc1c[nH]c2c(F)cccc12)C(C)CC
CCN(C)CCc1c[nH]c2c(F)c(F)c(F)cc12
CCCN(CC)CCc1c[nH]c2c(F)c(F)c(F)cc12
CCCN(CC)CCc1c[nH]c2c(F)cc(C)cc12
CC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CC1
CCN(C)CCc1c[nH]c2c(C)cc(F)cc12
CCC(C)N(CCc1c[nH]c2ccc(F)cc12)C1CC1
Fc1ccc2[nH]cc(CCN(C3CC3)C3CCC3)c2c1
CCN(C)CCc1c[nH]c2c(Br)cc(F)cc12
CCN(C)CCc1c[nH]c2cc(C)c(F)cc12
CCC(C)N(CCc1c[nH]c2ccc(F)cc12)CC#C
CCC(C)N(CCc1c[nH]c2ccc(F)cc12)CC#N
CC(C=C)N(C)CCc1c[nH]c2ccc(F)cc12
CCN(C)CCc1c[nH]c2cc(F)c(Cl)cc12
CCCN(CCc1c[nH]c2c(F)cccc12)CC#C
CCCN(CCc1c[nH]c2c(F)cccc12)CC#N
CCN(C)CCc1c[nH]c2c(Cl)cc(F)cc12
CCCN1CCC[C@@H]1Cc1c[nH]c2ccc(F)cc12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2cc(F)c(F)cc12 |r|
CN1CCC[C@@H]1Cc1c[nH]c2c(F)cccc12 |r|
CC(CN)c1c[nH]c2ccc(F)cc12
CN1CCN2C3CCN(CCCC(=O)c4ccc(F)cc4)CC3c3cccc1c23
CN1CCN(CC1(C)C)[C@@H]1C[C@H](c2ccc(Cl)cc12)c1ccccc1 |r|
CCCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CCN(CC)C(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCCF)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCCF)C1
CCCN1C[C@@H](C(=O)N[C@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CCCN1C[C@H](C(=O)N[C@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CCCN1C[C@H](C(=O)NC(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CCC[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCC)C1
CCCN1C[C@H](C(=O)N2[C@@H](C)C[C@@H]2C)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CC[C@@H](C)NC(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC)C1
CC[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC)C1
C=CCN1C[C@@H](C(=O)N[C@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
C=CCN1C[C@H](C(=O)N[C@H](C)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2OC)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccccc2OC)C1
C[C@H]1C[C@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CC[C@@H](C)NC(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CC[C@@H](C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:22|
CCC(CC)NC(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2NC1
CCC[C@@H](C)NC(=O)[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCC[C@@H](C)NC(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCC(F)(F)F)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CC2CC2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccc2O)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2cccc(OC)c2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2C(Cc2ccc(OC)cc2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2cccc(OC)c2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2ccc(OC)cc2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(Cc2ccccn2)C1
CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(CCc2cccnc2)C1
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(CCN(C)C)c2cc(OC)ccc21
[2H]C([2H])(c1cn(C(=O)CCCCCCC/C=CC/C=CCCCCC)c2ccccc12)[C@H]1CCCN1C([2H])([2H])[2H]
[2H]C([2H])(c1cn(C(=O)CCCCCCC/C=CC/C=CCCCCC)c2ccc(OC)cc12)[C@H]1CCCN1C([2H])([2H])[2H]
[2H]C([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])c1cn(C(=O)CCCCCCC/C=CC/C=CCCCCC)c2ccc(OC)cc12
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(C[C@H]2CCCN2C)c2ccccc21
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(C[C@H]2CCCN2C)c2cc(OC)ccc21
[2H]c1c([2H])c([2H])c2c(c1[2H])c(CCN(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])n2C(=O)CCCCCCC/C=CC/C=CCCCCC
[2H]C([2H])([2H])N(CCc1cn(C(=O)CCCCCCC/C=CC/C=CCCCCC)c2ccccc12)C([2H])([2H])[2H]
[2H]C([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])c1cn(C(=O)CCCCCCC/C=CC/C=CCCCCC)c2cccc(F)c12
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(C2CCN(C)CC2)c2ccccc21
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(C2CCN(C)C2)c2ccccc21
CCCCC/C=CC/C=CCCCCCCCC(=O)n1cc(C2CCN(C)C2)c2cc(OC)ccc21
[2H]C([2H])([2H])N3CCC(c1cn(C(=O)CCCCCCC/C=C/C/C=C/CCCCC)c2ccc(OC)cc12)CC3
CCCN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3(C)C)CC1
Cc1ccc(-c2ccc3c(c2)CN(C2CCCC2)CCC3(C)C)cc1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2C2CC2)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)c2ccc(F)cc2)ccc1OCCN1CCC1
CCOCCC(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)noc2C)c1
COc4cccc(C(=O)Nc3ccc(OCCN1CCC1)c(c2c(C)noc2C)c3)c4
Cc1noc(C)c1-c1cc(NC(=O)c2ccncc2)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)Cc2ccccc2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)c2ccncc2F)ccc1OCCN1CCCC1
COc1cccc(CC(=O)Nc2ccc(OCCN3CCC3)c(-c3c(C)noc3C)c2)c1
Cc1noc(C)c1-c1cc(NC(=O)c2cc(F)ccn2)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)Cc2cccc(F)c2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)c2cc(Cl)ccn2)ccc1OCCN1CCCC1
COc4ccc(CC(=O)Nc3ccc(OCCN1CCC1)c(c2c(C)noc2C)c3)cc4
Cc1noc(C)c1-c1cc(NC(=O)[C@@H]2C[C@H]2F)ccc1OCCN1CCCC1
Cc1ncsc1CC(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)[C@H]2C[C@H]2F)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)Cc2cncc(F)c2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)Cc2ccc(F)cn2)ccc1OCCN1CCC1
Cc1ncsc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OCCN1CCC1
Cc1nc(C)c(C(=O)Nc2ccc(OCCN3CCCC3)c(-c3c(C)noc3C)c2)s1
CCOC1CC1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)noc2C)c1
Cc1cnoc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC1CN(C)C1
Cc1ncoc1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)noc2C)c1
CCN1CC(Oc2ccc(NC(=O)C3CC3)cc2-c2c(C)noc2C)C1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OCCN1CCOCC1
Cc1noc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OCCN1CCCC1
CCOC1CC1C(=O)Nc1ccc(OCCN2CCOCC2)c(-c2c(C)noc2C)c1
CCOC1CC1C(=O)Nc1ccc(OCCN2CCCC2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN2C(=O)OCC2C1
Cc1noc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1CCCC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCOC(=O)CC1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN2C(=O)CCC2C1
Cc1noc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1CCC1
Cc1noc(C)c1c3cc(NC(=O)C2CC2)ccc3OCCN4CCC5(CC4)CNC5=O
Cc1ncsc1C(=O)Nc1ccc(OCCN2CCC2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CC1)CC(=O)N2
Cc1noc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CCC(=O)O2)CC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC2(CCOC2=O)CC1
Cc1noc(C)c1c3cc(NC(=O)C2CC2)ccc3OC4CNC4
COC1CCN(CCOc2ccc(NC(=O)C3CC3)cc2-c2c(C)noc2C)CC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1COCCN1
CO[C@H]4CCN(CCOc2ccc(NC(=O)C1CC1)cc2c3c(C)noc3C)C4
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCC1CCN1
CO[C@@H]4CCN(CCOc2ccc(NC(=O)C1CC1)cc2c3c(C)noc3C)C4
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1CCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC(O)CC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1CCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC[C@H](O)C1
Cc1noc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC[C@@H](O)C1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@H]1CCCNC1
CCN(C)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)noc1C
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@@H]1CCCNC1
CCCN(C)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)noc1C
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@H]1CCNC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)CC1CC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC1CCNC1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN(C)C1CCC1
Cc1noc(C)c1-c1cc(NC(=O)c2cnoc2)ccc1OC[C@H]1CCCCN1
CCN(CC)CCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)noc1C
Cc1nocc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC1
Cc1noc(C)c1-c1cc(NC(=O)c2cnoc2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC2(COC2)C1
Cc1noc(C)c1-c1cc(NC(=O)c2ncoc2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCN(C)C(=O)C1
Cc1noc(C)c1-c1cc(NC(=O)c2cnsc2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC12COC2
Cc1nscc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCC(CC(=O)O)CC1
Cc1noc(C)c1-c1cc(NC(=O)c2ncsc2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1[C@@H]2COC[C@H]1C2
Cc1noc(C)c1-c1cc(NC(=O)c2cccn2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1noc(C)c1-c1cc(NC(=O)[C@@H]2C[C@H]2F)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1noc(C)c1-c1cc(NC(=O)[C@H]2C[C@H]2F)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1noc(C)c1-c1cc(NC(=O)[C@@H]2C[C@@H]2F)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)c2ccnn2C)ccc1OCCN1C[C@@H]2C[C@H]1CO2
Cc1ncsc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1C[C@H]2C[C@H]2C1
Cc1nc(C)c(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)s1
Cc1noc(C)c1-c1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1OCCN1CCOCC1
Cc1cnoc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCOCC1
Cc1ncoc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CCCC1
COCCNCCOc2ccc(NC(=O)C1CC1)cc2c3c(C)noc3C
CC(=O)N1CCN(CCOc2ccc(NC(=O)C3CC3)cc2-c2c(C)noc2C)CC1
CC(=N)NCCOc1ccc(NC(=O)C2CC2)cc1-c1c(C)noc1C
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C(C)(C)F)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2(CF)CC2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@@H]1COCCN1
Cc1noc(C)c1-c1cc(NC(=O)C[C@@H]2CCOC2)ccc1OC[C@H]1CCCCN1
CC/C(=C(/C)ON)c1cc(NC(=O)C[C@H]2CCOC2)ccc1OC[C@H]1CCCCN1
COc4ccc(CC(=O)Nc3ccc(OC[C@H]1CCCCN1)c(c2c(C)noc2C)c3)cc4
Cc1noc(C)c1-c1cc(NC(=O)C2CC23CCOCC3)ccc1OC[C@H]1CCCCN1
Cc1ncsc1CC(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
COCC4(C(=O)Nc3ccc(OC[C@H]1CCCCN1)c(c2c(C)noc2C)c3)CC4
Cc1noc(C)c1-c1cc(NC(=O)Cc2cncc(F)c2)ccc1OC[C@H]1CCCCN1
COC1(CC(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)CCC1
Cc1noc(C)c1-c1cc(NC(=O)Cc2ccc(F)cn2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C(F)c2ccccc2)ccc1OC[C@H]1CCCCN1
COC1(CC(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)CC1
Cc1nc(C)c(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)o1
CCOC1CC1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1cnn(C)c1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)c2c(F)cnn2C)ccc1OC[C@H]1CCCCN1
CCc1cc(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)n(C)n1
Cc1nc(C(C)C)sc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1nc(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)c(C)s1
Cc1nonc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(NC(=O)c2cnn(C)c2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)Cc2ccns2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)c2ncnn2C)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)Cc2cnsc2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)Cc2nccs2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1O[C@@H]1CCCNC1
Cc1cnsc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
Cc1noc(C)c1-c1cc(N(C)C(=O)C2CC2)ccc1OC[C@H]1CCCCN1
Cc1nnsc1C(=O)Nc1ccc(OC[C@H]2CCCCN2)c(-c2c(C)noc2C)c1
COCCNCCOc2ccc(NC(=O)C1(F)CC1)cc2c3c(C)noc3C
Cc1nc(C(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)c(C)o1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1O[C@@H]1CCNC1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1-c1cc(NC(=O)C2(F)CC2)ccc1O[C@H]1CCNC1
Cc1noc(C)c1-c1cc(NC(=O)c2ccccc2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1c3cc(NC(=O)c2c(F)cnn2C)ccc3OC4CNC4
Cc1noc(C)c1-c1cc(NC(=O)c2ccc(F)cc2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1c3cc(NC(=O)c2ccccc2)ccc3OC4CNC4
COc4cccc(C(=O)Nc3ccc(OC[C@H]1CCCCN1)c(c2c(C)noc2C)c3)c4
Cc1noc(C)c1c3cc(NC(=O)c2ccc(F)cc2)ccc3OC4CNC4
Cc1noc(C)c1-c1cc(NC(=O)Cc2ccccc2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1c3cc(NC(=O)c2cccc(F)c2)ccc3OC4CNC4
COc1cccc(CC(=O)Nc2ccc(OC[C@H]3CCCCN3)c(-c3c(C)noc3C)c2)c1
COc4cccc(C(=O)Nc3ccc(OC1CNC1)c(c2c(C)noc2C)c3)c4
Cc1noc(C)c1-c1cc(NC(=O)Cc2cccc(F)c2)ccc1OC[C@H]1CCCCN1
Cc1noc(C)c1c3cc(NC(=O)C2(F)CC2)ccc3OC4CNC4
c1cc2c3c(csc3c1)CC1CNCCN21
CCCN1CCN2c3cccc4scc(c34)CC2C1
OCCN1CCN2c3cccc4scc(c34)CC2C1
c1cc2c3c(csc3c1)CC1CN(CC3CC3)CCN21
Fc1ccc(CCN2CCN3c4cccc5scc(c45)CC3C2)cc1
c1csc(CCN2CCN3c4cccc5scc(c45)CC3C2)c1
c1ccc(-c2cccc(CN3CCN4c5cccc6scc(c56)CC4C3)c2)cc1
Fc1ccc(-c2cncc(CN3CCN4c5cccc6scc(c56)CC4C3)c2)cc1
O=C1NCCN1c1cccc(CN2CCN3c4cccc5scc(c45)CC3C2)c1
O=C(CN1CCN2c3cccc4scc(c34)CC2C1)c1ccc(F)cc1
O=C(CCCN1CCN2c3cccc4scc(c34)CC2C1)c1ccc(F)cc1
O=C(NCCN1CCN2c3cccc4scc(c34)CC2C1)c1ccc(F)cc1
O=C(NCCN1CCN2c3cccc4scc(c34)CC2C1)C1CCOCC1
c1ccc(OCCN2CCN3c4cccc5scc(c45)CC3C2)cc1
c1cc2c3c(csc3c1)CC1CN(CCCOc3ccc4c(c3)OCO4)CCN21
O=c1ccc2ccc(OCCCN3CCN4c5cccc6scc(c56)CC4C3)cc2[nH]1
O=C1CCc2ccc(OCCCN3CCN4c5cccc6scc(c56)CC4C3)cc2N1
O=c1ccc2ccc(OCCCCN3CCN4c5cccc6scc(c56)CC4C3)cc2[nH]1
O=C1CCc2ccc(OCCCCN3CCN4c5cccc6scc(c56)CC4C3)cc2N1
c1cc2c3c(csc3c1)CC1CN(CCCCOc3ccc4scnc4c3)CCN21
O=C1c2ccccc2CN1CCCCN1CCN2c3cccc4scc(c34)CC2C1
COc1cc2c(cc1OC)C(=O)N(CCCCN1CCN3c4cccc5scc(c45)CC3C1)C2
O=C1c2ccccc2CCN1CCCCN1CCN2c3cccc4scc(c34)CC2C1
O=C1c2ccccc2CCCN1CCCCN1CCN2c3cccc4scc(c34)CC2C1
O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCCN1CCN2c3cccc4scc(c34)CC2C1
CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN3c4cccc5scc(c45)CC3C2)CC1
CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN3c4cccc5scc(c45)C[C@@H]3C2)CC1
CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN3c4cccc5scc(c45)C[C@H]3C2)CC1
O=C(N[C@H]1CC[C@H](CCN2CCN3c4cccc5scc(c45)CC3C2)CC1)N1CCCC1
O=C(N[C@H]1CC[C@H](CCN2CCN3c4cccc5scc(c45)CC3C2)CC1)N1CCCCC1
CC[C@H]1C[C@@H]2C[C@@H]3[C@H]1[N@](C2)CCc4c3[nH]c5c4cc(cc5)OC
COc1cc(OC)c(OC)cc1CC(C)N
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C
C[C@@H]1C[C@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
C[C@@H]1C[C@@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
C[C@@H]1C[C@@H](C)N1C(=O)C1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCc1[nH]c2ccc(OC)cc2c1CCN(C)C
CCOCN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1
COCN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1
CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCC(=O)c4ccc(F)cc4)CC[C@@H]32)N1
COc5cnc4C(=O)N(CCN3CCN(c1nsc2ccccc12)CC3)CCc4c5
O=c1c2ncccc2ccn1CCN1CCN(c2nsc3cc(F)ccc23)CC1
COc5cc4C(=O)N(CCN3CCN(c1nsc2ccccc12)CC3)CCc4cn5
Cn1ncc2c1CCCC(CCN1CCN(c3noc4ccccc34)CC1)C2=O
Cc1noc2c1C(=O)N(CCN1CCN(c3noc4ccccc34)CC1)CCC2
Cc1nc2c(o1)CCN(CCN1CCN(c3noc4ccccc34)CC1)C2=O
Cc1cc2c(o1)C(=O)N(CCN1CCN(c3nsc4ccccc34)CC1)CC2
O=C1c2oc(C3CC3)nc2CCC1CCN1CCN(c2nsc3ccccc23)CC1
CC1CC(CCN2CCC(c3noc4ccccc34)CC2)C(=O)c2ccn(C)c21
O=c2c1cnc(C(F)(F)F)cc1ccn2CCN5CCC(c3noc4ccccc34)CC5
N#Cc1cc2c(cn1)C(=O)N(CCN1CCN(c3nsc4ccccc34)CC1)CC2
[2H]C([2H])([2H])Oc1cc2c(cn1)C(=O)N(CCN1CCN(c3nsc4ccccc34)CC1)CC2([2H])[2H]
COc1ccc2c(N3CCN(CCN4CCc5cccnc5C4=O)CC3)noc2c1
CN1C(=O)CN2c3c(cccc31)[C@@H]1CN(CCCOc3ccc(F)cc3)CC[C@@H]12
CN1CCN2c3c1cccc3[C@H]4[C@@H]2CCN(C4)CCCC(=O)c5ccc(cc5)F
CC(C)COc1ccc(CC2=NOC3(CCN(C)CC3)N2Cc2ccc(F)cc2)cc1
CC(C)COc1ccc(C[C@H]2C(=O)NC3(CCN(C)CC3)N2Cc2ccc(F)cc2)cc1
CC(C)COc1ccc(CC2=NOC3(CCNCC3)N2Cc2ccc(F)cc2O)cc1
CC(C)COc1ccc(CN=C2NC(=O)CC3(CCN(C)CC3)N2Cc2ccc(F)cc2)cc1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)co1
CCCOc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2ccn(C)n2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C2=NC(=O)C3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2coc(C3CC3)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)cs1
CC(C)COc1ccc(CN(Cc2coc(CF)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2nc3cc(Cl)ccc3o2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2cc3ccccc3o2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(F)(F)C(F)(F)F)cc2F)C2=NOC3(CCN(C)CC3)N2)co1
CCCCOc1ccc(CN(Cc2coc(CF)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCCOc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)c(F)c1
CCCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1F
Cc1nc(CN(Cc2ccc(CCC(F)(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2F)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(C)C)c(F)c2)C2=NOC3(CCNCC3)N2)co1
CC(C)COc1ccc(CC2=NOC3(CCN(C)CC3)N2Cc2ccc(F)cc2O)cc1
COc1ccc(CNC2=NOC3(CCN(C)CC3)N2Cc2ccc(F)cc2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C2=NOC3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CCC2=NOC3(CCN(C)CC3)N2Cc2ccc(F)cc2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CN1CCC2(CC1)NC(N(Cc1ccc(OCC(F)(F)C(F)F)cc1)Cc1ccn(C)n1)=NO2
CC(C)COc1ccc(CN(Cc2ccccn2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1cccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)n1
CCCOc1ccc(CN(Cc2ccn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C(F)F)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1ccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)nc1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)cs1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)no1
CC(C)COc1ccc(CN(Cc2cn(C)cn2)C2=NOC3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cc2)C2=NC3(CCN(C)CC3)CO2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cc2)C2=NC(=O)C3(CCNCC3)N2)cc1
CC(C)CNc1ccc(CN(Cc2ccn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC3)N2Cc2ccc(F)cn2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC3)N2Cc2ccn(C)n2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2ccc(F)cn2)cc1
CCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2cc(C)n(C)n2)cc1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C2=NC(=O)C3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2cocn2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1cnc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)o1
COc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2cc(C)n(C)n2)cc1
Cc1cc(CN2C(Cc3ccc(OC(F)F)cc3)=NOC23CCN(C)CC32CC2)nn1C
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C2=NOC3(CCNCC3)N2)cc1
CCCOc1ccc(CC2=NOC3(CCNCC34CC4)N2Cc2ccn(C)n2)cc1
Cn1ccc(CN2C(Cc3ccc(OC4CC4)cc3)=NOC23CCNCC32CC2)n1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)co1
CCCOc1ccc(CNC2=NOC3(CCN(C)CC34CC4)N2Cc2ccn(C)n2)cc1
CN1CCC2(ON=C(Cc3ccc(OC4CC4)cc3)N2Cc2ccn(C)n2)C2(CC2)C1
CC(C)COc1ccc(CN(Cc2ccc(F)cn2)C2=NC(=O)C3(CCN(C)CC34CC4)N2)cc1
CC(C)COc1ccc(CN(Cc2ccn(C)n2)C2=NC(=O)C3(CCN(C)CC34CC4)N2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2ccn(C)n2)cc1
CCCOc1ccc(CC2=NOC3(CCN(C)CC34CC4)N2Cc2ccn(C)n2)cc1
CC(C)COc1ccc(CN(Cc2cnn(C)c2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccc(OCC(F)(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCNCC3)N2)co1
CC(C)COc1ccc(CN(Cc2coc(C(F)F)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC3(CCNCC3)ON2C)co1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC3(CCN(C)CC3)ON2C)co1
Cc1ncc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)o1
Cc1coc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)n1
CC(C)COc1ccc(CN(Cc2ccc(F)cc2)C2=NOC3(CCN(C)CC3)N2)cc1
CN1CCC2(CC1)NC(N(CC(=O)Nc1ccc(Cl)cc1)Cc1ccn(C)n1)=NO2
Cc1cc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)nn1C
Cc1ccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)cn1
CC(C)COc1ccc(CN(Cc2ccc(F)cc2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1cnc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)nc1
Cc1ccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NC(=O)C3(CCN(C)CC3)N2)nc1
CC(C)COc1ccc(CN(Cc2ccco2)C2=NC(=O)C3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccc(OCC(F)(F)C(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(C)(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
CCc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2cccs2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1cc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)co1
COc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccsc2)C2=NOC3(CCN(C)CC3)N2)co1
CC(C)COc1ccc(CN(C2=NOC3(CCN(C)CC3)N2)C(C)c2ccc(F)cc2)cc1
Cc1cc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)no1
Cc1cc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)on1
CCCCc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1ccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCNCC3)N2)cn1
Cc1nc(CN(Cc2ccc(OCC3CC3)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1ccc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)cn1
Cc1nc(CN(Cc2ccc(OCC(F)(F)C(F)(F)F)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC3CCC3)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC3CC(F)(F)C3)cc2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NO[C@@]3(CCNC[C@H]3F)N2)co1
CN1CCC2(CC1)NC(N(Cc1ccc(OCC(F)(F)F)cc1)Cc1coc(C3CC3)n1)=NO2
COc1ccc2oc(CN(Cc3coc(C)n3)C3=NOC4(CCN(C)CC4)N3)nc2c1
CC1NC(CN(Cc2nc3cc(Br)ccc3o2)C2=NOC3(CCN(C)CC3)N2)=CO1
Cc1nc(CN(Cc2cn3ccccc3n2)C2=NOC3(CCN(C)CC3)N2)co1
CCCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)c(Br)c1
Cc1nc(CN(Cc2ccc3c(c2)nnn3C)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2nc3ccccc3o2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2cnc3ccccc3c2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc3ncccc3c2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2ccc3ccccc3c2)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2nc3ccccc3s2)C2=NOC3(CCN(C)CC3)N2)co1
CC(C)COc1ccc(CN(Cc2ccn(C3CC3)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1ccc2cc(CN(Cc3coc(C)n3)C3=NOC4(CCN(C)CC4)N3)sc2c1
Cc1nc(CN(Cc2cc3ccc(Br)cc3s2)C2=NOC3(CCN(C)CC3)N2)co1
CN1CCC2(CC1)NC(N(Cc1cnn(C)n1)Cc1ccc(OCC(F)(F)C(F)(F)F)cc1F)=NO2
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)c(F)c1
CC(C)COc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1F
CN1CCC2(CC1)NC(N(Cc1coc(C3CC3)n1)Cc1ccc(OCC(F)(F)F)cc1F)=NO2
CCCc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)c(F)c1
CCCc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1F
CCCCOc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1F
CCCCOc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)c(F)c1
CN1CCC2(CC1)NC(N(Cc1ccc(OCC(F)(F)F)c(F)c1)Cc1coc(C3CC3)n1)=NO2
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2)C2=NOC3(CCN(C)CC3)N2)c(C)o1
CC(C)COc1ccc(CN(Cc2coc(-c3ccccc3)n2)C2=NOC3(CCN(C)CC3)N2)cc1
Cc1nc(CN(Cc2ccc(Cc3ccccc3)cc2)C2=NOC3(CCN(C)CC3)N2)co1
COc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cn1
COc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)nc1
Cc1nc(CN(Cc2csc3ccccc23)C2=NOC3(CCN(C)CC3)N2)co1
Cc1nc(CN(Cc2cc3ccccc3s2)C2=NOC3(CCN(C)CC3)N2)co1
CCOCc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCN(C)CC3)N2)c(Cl)c1
Cc1nc(CN(Cc2ccc(OCC(C)C)c(F)c2)C2=NOC3(CCN(C)CC3)N2)co1
CCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCNCC3)N2)c(Cl)c1
Cc1nc(CN(Cc2ccc(OCC(C)C)cc2F)C2=NOC3(CCNCC3)N2)co1
CN1CCC2(CC1)NC(N(Cc1ccc(OCC(F)(F)F)cc1)Cc1coc(CF)n1)=NO2
CCCCc1ccc(CN(Cc2cnn(C)n2)C2=NOC3(CCN(C)CC3)N2)cc1
CCCCOc1ccc(CN(Cc2coc(C)n2)C2=NOC3(CCNCC3)N2)cc1
[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1C1CCNCC1
[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1C1CCN(C)CC1
[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1C1=CCN(C)CC1
[2H]C([2H])([2H])N1CCC(c2c[nH]c3ccccc23)CC1
[2H]C([2H])([2H])N1CCC(c2c[nH]c3ccc(OC)cc23)CC1
[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1C1CCN(C)C1
[2H]c1[nH]c2c([2H])c([2H])c([2H])c([2H])c2c1C1CC([2H])([2H])N(C)C1([2H])[2H]
[2H]C([2H])([2H])N1CCC(c2c[nH]c3ccccc23)C1
[2H]C1([2H])CC(c2c[nH]c3ccc(OC)cc23)C([2H])([2H])N1C
CNC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:5.4,wD:8.8,(9.63,-1.34,;8.86,-0,;7.32,-0,;6.55,1.33,;6.55,-1.34,;5.01,-1.34,;4.24,-2.67,;2.7,-2.67,;1.93,-1.34,;.39,-1.34,;-.38,-0,;-1.92,-0,;-2.69,-1.34,;-4.23,-1.34,;-5,-0,;-4.23,1.33,;-2.69,1.33,;-6.54,-0,;-7.31,-1.33,;-8.85,-1.33,;-9.62,-0,;-8.86,1.34,;-9.63,2.66,;-7.32,1.34,;-6.55,2.67,;2.7,-0,;4.24,-0,)|
COc1cccc2c3CCN(CCCCOc4ccc5ccc(=O)[nH]c5c4)Cc3oc12
COc1cccc2c3CCN(CCCCOc4ccc5CCC(=O)Nc5c4)Cc3oc12
CCOc1cccc2c3c(oc12)CN(CCCCOc1ccc2c(c1)CC(=O)C=C2)CC3
COc1cccc2c3c(oc12)CN(CCCCc1ccc2ccc(=O)[nH]c2c1)CC3
COc1cccc2c3c(oc12)CN(CC1(O)CCCCC1)CC3
CCOc1cccc2c3c(oc12)CN(CC1(O)CCCCC1)CC3
CCOc1cccc2c3c(oc12)CN(CCCCOc1ccc2c(n1)CC(=O)C=C2)CC3
COc1cccc2c3c([nH]c12)CN(CC[C@H]1CC[C@H](NC(=O)N(C)C)CC1)CC3
CN(C)C(=O)NC1CCC(CC1)CCN2CCN(CC2)c3cccc(c3Cl)Cl
COc1ccccc1CN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCN3C
CN1CCN2c3c(cccc31)[C@@H]1CN(Cc3ccccc3O)CC[C@@H]12
COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCN3C
COc1cccc(CCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CCN4C)c1
COc1ccc(CCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CCN4C)cc1
COc1cccc(CCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CCN4C)c1OC
COc1ccc(CCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CCN4C)c(OC)c1
COc1ccc(OC)c(CCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CCN4C)c1
CN1CCN2c3c(cccc31)[C@@H]1CN(CCc3ccccc3O)CC[C@@H]12
CN1CCN2c3c1cccc3[C@H]4[C@@H]2CCN(C4)CCCc5ccccc5OC
CN1CCN2c3c(cccc31)[C@@H]1CN(CCCc3ccccc3O)CC[C@@H]12
COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCCN3C
COc1ccccc1CCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCCN3C
COc1ccccc1CCCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCCN3C
COc1ccccc1CCCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCCN3C
COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCC3
COc1ccccc1CCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCC3
COc1ccccc1CCCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCC3
COc1ccccc1CCCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCC3
COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCO3
COc1ccccc1CCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCO3
COc1ccccc1CCCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCO3
COc1ccccc1CCCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCO3
COc1ccccc1CCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCCS3
COc1ccccc1CCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCCS3
COc1ccccc1CCCN1CC[C@H]2[C@@H](C1)c1cccc3c1N2CCCS3
COc1ccccc1CCCN1CC[C@@H]2[C@H](C1)c1cccc3c1N2CCCS3
Fc1ccc(cc1)[Si]1(CCC(C1)N1CCN(CC1)c1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)[Si]1(CCC(C1)N1CCN(CC1)c1ccccc1)c1ccccc1
Fc1ccc(cc1)C(=O)C1CCNCC1
OC(CCN1C(=O)CC2(CCCC2)CC1=O)CN1CCN(CC1)c1nsc2ccccc12
OC1CCC2(C1)CC(=O)N(CCCCN1CCN(CC1)c1nsc3ccccc13)C(=O)C2
OC(CCN1C(=O)CC2(CCC(O)C2)CC1=O)CN1CCN(CC1)c1nsc2ccccc12
O=C1CCC2(C1)CC(=O)N(CCCCN1CCN(CC1)c1nsc3ccccc13)C(=O)C2
OC1C(=O)N(CCCCN2CCN(CC2)c2nsc3ccccc23)C(=O)CC11CCCC1
O=C(NCCCCN1CCN(CC1)c1nsc2ccccc12)C1OC(=O)CC11CCCC1
C1CN(CCN1)c1nsc2ccccc12
CCC(=O)N(C1CCN(CCCOc2ccc(F)cc2)CC1)C1CCCCCCC1
CC(C)NC(=O)N(C1CCN(CCCOc2ccc(F)cc2)CC1)C1CCCCCCC1
[H][C@]12CC[C@]([H])(C[C@H](C1)N1CCC(CC1)c1c([nH]c3ccccc13)-c1ccccc1)N2C |r,TLB:9:7:30:2.3|
C(Cc1ccccc1)N1C2CCC1CC(C2)N1CCC(CC1)c1c([nH]c2ccccc12)-c1ccccc1 |TLB:0:8:14.13.15:10.11,THB:16:14:8:10.11|
CC1CCc2cc(F)cc3c(CCN)cn1c23
NCCc1cn2CCSc3cc(Cl)cc1c23
CNCCc1cn2C(C)CCc3cc(F)cc1c23
NCCc1cn2CCCc3cccc1c23
N#Cc1cc(CN2CCN(CC2)c2ccccc2)c[nH]1
COc1ccc2cc3CNCCn3c2c1
C1Cn2c(CN1)cc1ccccc21
CN(C)CCn1ccc2ccccc12
C[C@H](N)Cn1ccc2cc(F)c(F)cc12
COc1c2CNCCn2c2ccc(Cl)cc12
COc1ccc2n(CCN(C)C)ccc2c1
Clc1ccc2cc3CNCCn3c2c1
CN(C)CCn1ccc2cc(F)c(F)cc12
C1Cn2c(CN1)nc1ccccc21
COc1ccc2n3CCNCc3cc2c1
Clc1cccc2cc3CNCCn3c12
Clc1ccc2n3CCNCc3cc2c1
COc1cccc2cc3CNCCn3c12
CN(C)CC1(C)CC2N(O1)c1ccccc1Cc1ccccc21
CN(C)C[C@@H]1C[C@H]2N(O1)c1ccccc1Cc1ccccc21
CCOc1ccccc1-c1cccc2CC3CCNCCN3c12
FC(F)(F)c1ccccc1-c1cccc2CC3CCNCCN3c12
CCOc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12
Cc1ccccc1-c1cccc2CC3CCNCCN3c12
COc1ccc2c3CCNCc3[nH]c2c1
COc1cccc2[nH]c3CNCCc3c12
C1Cc2c(C=N1)[nH]c1ccccc21 |c:4|
COc1cccc2[nH]c3C=NCCc3c12 |c:9|
Brc1cccc2c3CCN=Cc3[nH]c12 |c:9|
c1ccc2c(c1)c3c([nH]2)CNCC3
Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
C1Cn2c3CCCCCCc3c3cccc(CN1)c23
CNC[C@@H]1C[C@@H]2[C@@H](O1)c1ccccc1Cc1ccccc21
C[C@H](N)CN1CCc2ccc3OCCCc3c12
CCSc1ccc2CCN(C[C@H](C)N)c2c1
C[C@H](N)CN1CCc2cc(F)c(Cl)cc12
C[C@H](N)Cn1ccc2cc(F)c(Cl)cc12
CSc1cc2N(C[C@H](C)N)CCc2cc1F
C[C@H](N)CN1CCc2ccc(Cl)cc12
CSc1ccc2CCN(C[C@H](C)N)c2c1
CCSc1cc2N(C[C@H](C)N)CCc2cc1F
C[C@H](N)CN1CCc2cc(F)c(cc12)C(F)(F)F
C[C@H](N)CN1CCc2cc(F)c(I)cc12
C[C@H](N)CN1CCc2ccc3OCCc3c12
CCCN(CCCCN1C(=O)C2CCCC2C1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
CCCN(CCNS(=O)(=O)c1ccc(C)cc1)C1COc2cccc(OC)c2C1
CCCN(CCCCNS(=O)(=O)c1ccc(C)cc1)C1COc2cccc(OC)c2C1
CCCN(CCC)C1COc2cccc(OC)c2C1
CCNCCc1c[nH]c2ccc(OC)cc12
CNCCc1c[nH]c2ccc(OC)cc12
COc1ccc2[nH]cc(CCNCc3ccc(F)cc3)c2c1
COc1cc(CCNCc2ccc(C)cc2)c(OC)cc1Br
COc1cc(CCNCc2ccc(F)cc2)c(OC)cc1Br
COc1ccc2[nH]cc(CCNCc3ccc(Cl)cc3)c2c1
COc1cc(CCNCc2ccc(I)cc2)c(OC)cc1Br
COc1ccc(CNCCc2cc(OC)c(Br)cc2OC)cc1
COc1ccc2[nH]cc(CCNCc3ccc(C)cc3)c2c1
COc1ccc2[nH]cc(CCNCc3ccccc3)c2c1
COc1ccc2[nH]cc(CCNCCCCc3ccccc3)c2c1
COc1ccc2[nH]cc(CCNCc3ccc(Br)cc3)c2c1
COc1cc(CCNCCCc2ccccc2)c(OC)cc1Br
COc1cc(CCNCc2ccc(cc2)[N+]([O-])=O)c(OC)cc1Br
COc1ccc2[nH]cc(CCN3CCCCC3)c2c1
CNCCc1cc(OC)c(Br)cc1OC
CCNCCc1cc(OC)c(Br)cc1OC
COc1cc(CCNCc2ccccc2)c(OC)cc1Br
COc1cc(CCNCc2ccc(N)cc2)c(OC)cc1Br
COc1cc(CCN2CCCCC2)c(OC)cc1Br
COc1ccc2[nH]cc(CCNCCCc3ccccc3)c2c1
COc1cc(CCNCc2ccc(Br)cc2)c(OC)cc1Br
COc1cc(CCNCCCCc2ccccc2)c(OC)cc1Br
COc1ccc2[nH]cc(CCNCc3ccc(I)cc3)c2c1
COc1cc(CCNCc2ccc(Cl)cc2)c(OC)cc1Br
COc1ccc2[nH]cc(CCNCc3ccc(cc3)[N+]([O-])=O)c2c1
COc1ccc(CNCCc2c[nH]c3ccc(OC)cc23)cc1
COc1ccc2[nH]cc(CCNCc3ccc(N)cc3)c2c1
COc1cc(CCN(C)C)c(OC)cc1Br
[#6]-[#7]-1-[#6]-[#6]-[#6](=[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |c:4,t:8|
CN1CCN(CC1(C)C)C1CC(c2ccc(Cl)cc12)c1ccc(F)cc1
CC1(C)CN(CCN1)C1CC(c2ccc(Cl)cc12)c1ccc(F)cc1
CC1(C)CN(CCN1)C1CC(c2ccsc2)c2ccc(Cl)cc12
CN1CCN(CC1(C)C)C1CC(c2ccc(Cl)cc12)c1ccccc1
CN1CCN(CC1(C)C)C1CC(c2ccc(F)cc12)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2ccccc12)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)C1CCN(CCc2ccccc2)CC1
CN1CCN(CC1)c1nc2sccc2n2cccc12
CC(N)Cc1c2CCOc2c(Br)c2CCOc12
CNc1cc(OC)c(cc1Cl)C(=O)NC1CCN(Cc2ccccc2)C1C
CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
C[C@H]1N(C)CCc2cc(Cl)c(O)cc2[C@@]1(C)c1ccccc1
CN1CCN(CC1(C)C)C1CC(c2ccccc12)c1ccccc1
CN1CCN(CC1(C)C)C1CC(c2ccc(Br)cc12)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2cccc(Cl)c12)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2ccc(Cl)cc12)c1ccccc1F
CN1CCN(CC1(C)C)C1CC(c2ccc(cc12)C(F)(F)F)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2ccc(C)cc12)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2cc(Cl)ccc12)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2ccc(Cl)cc12)c1cccc(F)c1
CN1CCN(CC1(C)C)C1CC(c2c1cccc2Cl)c1ccc(F)cc1
CC1(C)CN(CCN1)C1CC(c2ccc(cc12)C(F)(F)F)c1ccc(F)cc1
Cc1ccc2C(CC(N3CCNC(C)(C)C3)c2c1)c1ccc(F)cc1
CN1CCN(CC1(C)C)C1CC(c2ccc(Cl)cc12)c1ccc(Cl)cc1
CN1CCN(CC1(C)C)C1CC(c2ccsc2)c2ccc(Cl)cc12
CN1CCN(CC1(C)C)C1CC(c2cccc(F)c12)c1ccc(F)cc1
COc1cc(CCN)c2CCOc2c1OC
COc1c2OCCc2c(CCN)c2CCOc12
CCOc1c(OC)cc(CCN)cc1OC
CCCC(C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:23|
CCC[C@@H](C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:23|
CCCCC(C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|
CCCCCC(C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:25|
CCCC[C@@H](C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|
CCCCC[C@@H](C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:25|
CCC(CC)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:23|
CCC(C)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |c:22|
C[C@@H](N)Cc1c2CCOc2c(Br)c2CCOc12
COc1cc(Br)c2OC[C@H]3C[C@@H](N)Cc1c23
OCc1coc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2c1=O
COc1ccccc1N1CCN(CCNC(=O)c2noc3ccccc23)CC1
O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1nsc2ccccc12
COc1ccccc1N1CCN(CCCCN(C)C(=O)c2nsc3ccccc23)CC1
CC(C)N(CCCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1noc2ccccc12
CN(CCCCN1CCN(CC1)c1nsc2ccccc12)C(=O)c1nsc2ccccc12
CN1CCN(CCNC(=O)c2nsc3ccccc23)CC1
COc1ccccc1N1CCN(CCCNC(=O)c2nsc3ccccc23)CC1
O=C(NCCN1CCN(Cc2ccccc2)CC1)c1nsc2ccccc12
O=C(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1nsc2ccccc12
COc1ccccc1N1CCN(CCCN(C)C(=O)c2nsc3ccccc23)CC1
CN(CCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1nsc2ccccc12
COc1ccccc1N1CCN(CCCCNC(=O)c2nsc3ccccc23)CC1
CN(CCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1nsc2ccccc12
CN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1nsc2ccccc12
CN(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1noc2ccccc12
CC(C)N(CCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1noc2ccccc12
CN(CCCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1noc2ccccc12
CN(CCCCN1CCN(CC1)c1csc2cc(F)ccc12)C(=O)c1noc2ccccc12
Clc1ccc2c(noc2c1)C1CCN(CCCNC(=O)c2nsc3ccccc23)CC1
CN(CCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1noc2ccccc12
O=C(NCCN1CCN(CC1)c1nsc2ccccc12)c1nsc2ccccc12
COc1ccccc1N1CCN(CCNC(=O)c2nsc3ccccc23)CC1
CN(CCCCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1nsc2ccccc12
Clc1ccc2c(noc2c1)C1CCN(CCNC(=O)c2nsc3ccccc23)CC1
Clc1cccc(c1)N1CCN(CCNC(=O)c2nsc3ccccc23)CC1
CN(CCCN1CCC(CC1)C(=O)c1ccc(F)cc1)C(=O)c1nsc2ccccc12
CN(CCCCN1CCN(CC1)c1csc2cc(F)ccc12)C(=O)c1nsc2ccccc12
Fc1ccc2c(csc2c1)N1CCN(CCNC(=O)c2noc3ccccc23)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCNC(=O)c2nsc3ccccc23)CC1
CC1c2ccccc2C=C(N2CCN(C)CC2)c2ccccc12 |t:9|
CN1CCN(CC1)C1=Cc2ccccc2C(=C)c2ccccc12 |t:8|
CN1CCN(CC1)C1=Cc2ccccc2Oc2ccc(Cl)cc12 |t:8|
CC1c2ccccc2C=C(C2=CCN(C)CC2)c2ccccc12 |t:9,11|
[#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2cc(Cl)ccc2\[#6](=[#6](/[#6])-[#6])-c2ccccc-12 |t:8|
[#6]-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](\[#6])-[#6])-c2ccccc-12 |t:8|
CN1CCN(CC1)C1=Cc2ccccc2Cc2ccc(Cl)cc12 |t:8|
CN1CCN(CC1)C2=Nc3ccccc3Nc4c2cccc4
CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(C)c2ccccc12 |t:8|
C\C=C1\c2ccccc2C=C(N2CCN(C)CC2)c2ccccc12 |t:10|
CN1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12 |t:8|
CN1CCC(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12 |t:8|
C[C@H]1c2ccccc2C=C(C2=CCN(C)CC2)c2ccccc12 |t:9,11|
C[C@@H]1c2ccccc2C=C(C2=CCN(C)CC2)c2ccccc12 |t:9,11|
CN1CCN(CC1)C1=Cc2cc(Cl)ccc2Oc2ccccc12 |t:8|
CN1CCN(CC1)C1=Cc2ccccc2Oc2ccccc12 |t:8|
CN1CCC(=CC1)C1=Cc2ccccc2C(=C)c2ccccc12 |c:4,t:8|
CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
COc1cc2CCN(C(=O)Nc3cc(F)cc(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3cc(F)cc(F)c3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cc(Br)cc(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(nc3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(cc3)-c3ccncc3)c2cc1C(F)(F)F
COc1ccc(NC(=O)N2CCc3cc(OC)c(cc23)C(F)(F)F)cc1-c1cccnc1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1C(F)(F)F
CSc1cc2CCN(C(=O)Nc3cccc(c3)-c3ccncc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(C)c(c3)-c3cnccc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3)-c3cccnc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3)-c3c(C)ccnc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3Cl)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3c(F)cccc3F)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3ccc(F)cc3)c2cc1C(F)(F)F
CSc1cc2CCN(C(=O)Nc3cccc(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3)-c3ccccn3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cc(F)c(C)c(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3)-c3cnccc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3cnccc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3ccncc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cc(cc(c3)-c3cccnc3)-c3ccccc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(C)c(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cncc(c3)-c3ccccc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4)nc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cc4CCOc4c(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cc(ccc3F)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(Cl)c(c3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(cc3)-c3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(c(c3)-c3cccnc3)C(C)(C)C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3ccc(Cl)c(c3)-c3cnccc3C)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccc(c3C)-c3cccnc3)c2cc1C(F)(F)F
CCc1cc(NC(=O)N2CCc3cc(OC)c(cc23)C(F)(F)F)cc(c1)-c1cccnc1
CNc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(NC)n1
Nc1ccc(cc1)S(=O)(=O)c1cc(Br)nc(c1)N1CCCC1
FC(F)(F)Oc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:24|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1cccc(F)c1 |c:21|
COc1ccc(cc1Cl)N1CCC(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCC(C)(C)CC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCC(C)(C)CC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:23|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(C)cc1 |c:21|
COc1ccc(cc1OCCN1CCOCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:21|
CC(=O)Nc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1)N1CCC(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:21|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1cccc(c1)C(F)(F)F |c:21|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(C)cc1 |c:22|
Cc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:20|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(F)cc1 |c:21|
COc1ccc(cc1OCCN1CCCCC1)C1CCN(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)C1=CCN(C1=O)c1cccc(F)c1 |t:19|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)cc1 |c:21|
COc1ccc(cc1Cl)N1CC=C(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1 |c:12|
COc1ccc(cc1F)N1CC=C(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1 |c:12|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(F)cc1 |c:22|
COc1ccc(cc1OCCN1CCCCC1)C1=C(C)CN(C1=O)c1ccc(Cl)c(Cl)c1 |c:19|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(cc1)C(F)(F)F |c:22|
Cc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)C1=CCN(C1=O)c1ccc(Cl)c(Cl)c1 |t:19|
COc1ccc(cc1)N1CC=C(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1 |c:11|
COc1ccc(cc1OCCN1CCCCC1)C1(C)CCN(C1=O)c1ccc(Cl)c(Cl)c1
FC(F)(F)Oc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCC(C)(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)C1=C(C)CN(C1=O)c1ccc(Cl)cc1 |c:19|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(Cl)cc1 |c:22|
COc1ccc(cc1OCCN1CCC(CC1)C(C)C)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1F)N1CCC(C1=O)c1ccc(OC)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCC(F)(F)CC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:23|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(Br)cc1 |c:22|
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1cccc(Cl)c1 |c:21|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:22|
COc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1ccc(F)cc1
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1ccc(Cl)c(F)c1 |c:22|
COc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1cccc(Cl)c1
Clc1ccc(cc1Cl)C1CCN(C1=O)c1ccc(Cl)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:20|
COc1ccc(cc1OCCN1CCCCC1)C1CCN(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(cc1)C(F)(F)F |c:21|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CC=C(C1=O)c1cccc(Cl)c1 |c:22|
COc1ccc(cc1OCCN1CCCCC1)N1CCC(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Br)cc1 |c:21|
COc1ccc(cc1OCCN1CCC(C)CC1)N1CCC(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCC(C)CC1)N1CCC(C)(C1=O)c1ccc(Cl)c(Cl)c1
Clc1ccc(cc1Cl)C1=CCN(C1=O)c1ccc(N2CCCC2)c(OCCN2CCCCC2)c1 |t:9|
COc1ccc(cc1OCCN1CCC(CC1)C(C)C)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:24|
Clc1ccc(cc1Cl)C1=CCN(C1=O)c1ccc(Cl)c(OCCN2CCCCC2)c1 |t:9|
CC(=O)Nc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:23|
C[C@@H]1CNCCN1c1ccc2CC[C@H](OCc3cc(F)ccc3C)c2n1 |r|
[H][C@]12CC[NH+](CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CCN2c13
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)CC[C@@]1([H])c1cccc3OCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3NCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(CC)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(CCN2c13)C(C)C |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(CCCC)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(Cc4ccccc4)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cc(Br)cc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cc(OC)cc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccccc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccncc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)N3CCC(F)(F)CC3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCOc3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCNC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCc3noc4ccccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCc3noc4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCc3n[nH]c4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CC3CC(=NO3)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r,c:8|
[H][C@]12CCN(CCc3cc4CC(=O)Nc4cc3Cl)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCc3c(C)nc4cc(C)ccn4c3=O)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCCN3C(=O)[C@]4([H])CCCC[C@]4([H])C3=O)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCN3C(=O)[C@]4([H])CCCC[C@]4([H])C3=O)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@]1([H])c1cccc3NCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)CC[C@@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@@]12CCN(CCCC(=O)c3ccc(F)cc3)CC[C@]1([H])c1cccc3N(C)CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CC(C)N2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3N(C)CC(C)(C)N2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3CCCN2c13 |r|
[H][C@@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@]1([H])c1cccc3CCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3CCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3CCCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3SCCN2c13 |r|
[H][C@]12CCN(CCCC(=O)c3ccc(F)cc3)C[C@@]1([H])c1cccc3OCCN2c13 |r|
COc1cc(NC(=O)C2CC2)c(Cl)cc1C(=O)N[C@H]1CCN(Cc2ccccc2)C1
CC(N)Cc1c2CCOc2cc2CCOc12
NCCc1c2CCOc2cc2CCOc12
CN(CCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(C)CCCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12)CCN1CCNC1=O
CN1CCN(CCOc2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1
CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
CN(C)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Fc1ccc(cc1)-n1cc(OCCN2CCOCC2)c2cc(Cl)ccc12
CN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
CCN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
CC(C)N1CCN(CCN(C)CCOc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
CN(C)CCCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(C)CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
CC(C)N1CCN(CCN(C)CCc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
CN(CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Fc1ccc(cc1)-n1cc(OCCN(CCN2CCNC2=O)CC#C)c2cc(Cl)ccc12
CN(C)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(C)CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(C)CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CN(CCCCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Fc1ccc(cc1)-n1cc(OCCN2CCCCC2)c2cc(Cl)ccc12
CN(C)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
CN(CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
CN(C)CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
O=C1CN(CN2CCN(CC2)c2cccc3ccccc23)C(=O)[C@@H]2CCCN12
O=C(NCCN1CCC(CC1)c1nc2ccccc2o1)C1COc2ccccc2O1
O=C(NCCN1CCC(CC1)c1nc2ccccc2s1)C1COc2ccccc2O1
O=C(NCCCN1CCC(CC1)c1nc2ccccc2o1)C1COc2ccccc2O1
O=C(NCCCN1CCC(CC1)c1nc2ccccc2s1)C1COc2ccccc2O1
C(COCC1COc2ccccc2O1)CN1CCC(CC1)c1nc2ccccc2o1
C(COCC1COc2ccccc2O1)CN1CCC(CC1)c1nc2ccccc2s1
CC1Oc2ccccc2OC1COCCCN1CCC(CC1)c1nc2ccccc2o1
CC1Oc2ccccc2OC1COCCCN1CCC(CC1)c1nc2ccccc2s1
C(COCC1Oc2ccccc2OC1c1ccccc1)CN1CCC(CC1)c1nc2ccccc2o1
C(COCC1Oc2ccccc2OC1c1ccccc1)CN1CCC(CC1)c1nc2ccccc2s1
C(CCN1CCC(CC1)c1nc2ccccc2o1)COCC1Oc2ccccc2OC1c1ccccc1
C(CCN1CCC(CC1)c1nc2ccccc2s1)COCC1Oc2ccccc2OC1c1ccccc1
C(CCOCC1Oc2ccccc2OC1c1ccccc1)CCN1CCC(CC1)c1nc2ccccc2o1
C(CCOCC1Oc2ccccc2OC1c1ccccc1)CCN1CCC(CC1)c1nc2ccccc2s1
COc1ccccc1N1CCN(Cn2c(O)c3CCCCn3c2=O)CC1
CN1CCC(CC1)c1cccc2cc(cnc12)S(=O)(=O)c1ccccn1
CN1CCN(CC1)c1cccc2cc(cnc12)S(=O)(=O)c1cccc(F)c1
O=C1CC(CN1c1cnc2c(cccc2c1)N1CCNCC1)c1ccccc1
Cc1sc2nc(SCCCN3CCN(CC3)c3ncccn3)n(N)c(=O)c2c1C
COc1ccccc1C1CCN(CCCSc2nc3sc(C)c(C)c3c(=O)n2N)CC1
COc1ccccc1N1CCN(CCCSc2nc3sc(C)c(C)c3c(=O)n2N)CC1
Cc1cccc(c1)C(=O)NCN1CCN(CC1)c1ccccc1C#N
Cc1ccc2c3CCN(Cc4ccccc4)Cc3c(=O)oc2c1
C(CN1CCN(CC1)c1ncccn1)Cc1nc2ccccc2s1
Fc1cccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cc3ccccc3s2)CC1
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)NCCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cnc3ccccn23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cnc3ccccn23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cccc3scnc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cccc3scnc23)CC1
Cc1cccc(c1)S(=O)(=O)NCCN1CCN(CC1)c1nsc2ccccc12
Cc1cccc(c1)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Cc1cccc(c1)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
Clc1ccc(cc1Cl)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Clc1ccc(cc1Cl)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
Fc1ccc(cc1Cl)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Fc1ccc(cc1Cl)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
O=S(=O)(NCCCN1CCN(CC1)c1nsc2ccccc12)c1cccs1
O=S(=O)(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1cccs1
O=S(=O)(NCCN1CCN(CC1)c1nsc2ccccc12)c1ccc2ccccc2c1
O=S(=O)(NCCCN1CCN(CC1)c1nsc2ccccc12)c1ccc2ccccc2c1
O=S(=O)(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1ccc2ccccc2c1
Clc1ccc2cc(ccc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Clc1ccc2cc(ccc2c1)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
O=S(=O)(NCCCN1CCN(CC1)c1nsc2ccccc12)c1cc2ccccc2s1
O=S(=O)(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1cc2ccccc2s1
Clc1ccc2cc(sc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Clc1ccc2cc(sc2c1)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCN1CCN(CC1)c1nsc2ccccc12
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCCN1CCN(CC1)c1nsc2ccccc12
O=S(=O)(NCCCN1CCN(CC1)c1nsc2ccccc12)c1cnc2ccccn12
O=S(=O)(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1cnc2ccccn12
O=S(=O)(NCCCN1CCN(CC1)c1nsc2ccccc12)c1cccc2scnc12
O=S(=O)(NCCCCN1CCN(CC1)c1nsc2ccccc12)c1cccc2scnc12
Cc1cccc(c1)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Cc1cccc(c1)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
Clc1ccc(cc1Cl)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Clc1ccc(cc1Cl)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
Fc1ccc(cc1Cl)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Fc1ccc(cc1Cl)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
O=S(=O)(NCCCN1CCN(CC1)c1noc2ccccc12)c1cccs1
O=S(=O)(NCCCCN1CCN(CC1)c1noc2ccccc12)c1cccs1
O=S(=O)(NCCCN1CCN(CC1)c1noc2ccccc12)c1ccc2ccccc2c1
O=S(=O)(NCCCCN1CCN(CC1)c1noc2ccccc12)c1ccc2ccccc2c1
Clc1ccc2cc(ccc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Clc1ccc2cc(ccc2c1)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
O=S(=O)(NCCCN1CCN(CC1)c1noc2ccccc12)c1cc2ccccc2s1
O=S(=O)(NCCCCN1CCN(CC1)c1noc2ccccc12)c1cc2ccccc2s1
Clc1ccc2cc(sc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Clc1ccc2cc(sc2c1)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCN1CCN(CC1)c1noc2ccccc12
Cc1c(sc2ccc(F)cc12)S(=O)(=O)NCCCCN1CCN(CC1)c1noc2ccccc12
O=S(=O)(NCCCCN1CCN(CC1)c1noc2ccccc12)c1cnc2ccccn12
O=S(=O)(NCCCN1CCN(CC1)c1noc2ccccc12)c1cccc2scnc12
O=S(=O)(NCCCCN1CCN(CC1)c1noc2ccccc12)c1cccc2scnc12
Cc1cccc(c1)S(=O)(=O)NCCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1cccc(c1)S(=O)(=O)NCCCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1cccc(c1)S(=O)(=O)NCCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2ccc(F)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2ccc(F)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cccs2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cccs2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCNS(=O)(=O)c2cccc3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cccc3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cccc3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCNS(=O)(=O)c2ccc3ccccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2ccc3cc(Cl)ccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2ccc3cc(Cl)ccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2csc3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2csc3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cc3ccccc3s2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCNS(=O)(=O)c2cc3ccc(Cl)cc3s2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCNS(=O)(=O)c2cc3ccc(Cl)cc3s2)CC1
COc1cccc2[C@@H]3CN(CCn4c(=O)[nH]c5c6ncccc6sc5c4=O)C[C@@H]3CCc12
CCOC(=O)c1cc2cc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)ccn2n1
OCc1cc2cc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)ccn2n1
Clc1cccc(N2CCN(CCCCOc3ccn4ncc(C=O)c4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ccn4nc(C=O)cc4c3)CC2)c1Cl
O\N=C\c1cnn2ccc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)cc12
O\N=C\c1cc2cc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)ccn2n1
Clc1cccc(N2CCN(CCCCOc3ccn4ncc(C#N)c4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ccn4nc(cc4c3)C#N)CC2)c1Cl
CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(O)cc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(O)ccc2Nc2ccccc12 |t:8|
COc1ccc2Nc3ccccc3N=C(N3CCN(C)CC3)c2c1 |t:14|
CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(OS(=O)(=O)C(F)(F)F)cc12 |t:8|
COc1ccc2Nc3ccccc3C(=Nc2c1)N1CCN(C)CC1 |c:14|
CN1CCN(CC1)C1=Nc2cc(OS(=O)(=O)C(F)(F)F)ccc2Nc2ccccc12 |t:8|
C(c1ccccc1)c1ncc2CCNCCc2n1
COc1nc(Cc2ccccc2)nc2CCNCCc12
CNc1nc(Cc2ccccc2)nc2[C@@H](C)CNCCc12 |r|
CNc1nc(nc2CCNCCc12)C(F)(F)c1ccccc1
COc1cc(\C=C\C(=O)NCCn2c(cc3ccccc23)C(F)(F)F)cc(OC)c1OC
Cn1c2ccc(CCN3CCN(CC3)c3ccc(F)cc3)cc2sc1=O
O=c1[nH]c2ccc(CCN3CCN(CC3)c3ccccc3)cc2s1
COc1ccccc1N1CCN(CCCCc2ccc3[nH]c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCc2ccc3N(C)C(=O)COc3c2)CC1
CN1C(=O)COc2cc(CCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)ccc12
COc1ccccc1N1CCN(CCCCc2ccc3N(C)C(=O)COc3c2)CC1
Cn1c2ccc(CCN3CCN(CC3)c3ccccc3O)cc2sc1=O
Oc1ccccc1N1CCN(CCc2ccc3[nH]c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCCCc2ccc3n(C)c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCCc2ccc3n(C)c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCc2ccc3[nH]c(=O)sc3c2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCc2ccc3[nH]c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCc2ccc3n(C)c(=O)sc3c2)CC1
Cn1c2ccc(CCN3CCN(CC3)c3ccccc3)cc2sc1=O
Cn1c2ccc(CCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2sc1=O
CN1C(=O)COc2cc(CCN3CCN(CC3)c3cccc(c3)C(F)(F)F)ccc12
FC(F)(F)c1cccc(c1)N1CCN(CCc2ccc3[nH]c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCCc2ccc3[nH]c(=O)sc3c2)CC1
Cn1c2ccc(CCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2sc1=O
COc1ccc2OC[C@H]3C[C@H](Cc1c23)N(C)C
CCCN(CCC)[C@@H]1C[C@@H]2COc3ccc(OC)c(C1)c23
COc1cc(Br)c2OC[C@@H]3C[C@@H](N)Cc1c23
COc1ccc(cc1)N1CCN(CC[C@H]2OCCc3cc(ccc23)C(N)=O)CC1
CNC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc(OC)cc3)OCCc2c1 |r|
CNC(=O)c1ccc2[C@@H](CCN3CCN(CC3)c3ccc(OC)cc3)OCCc2c1
COc1ccc(cc1)N1CCN(CCC2OCCc3ccccc23)CC1
COc1ccc(cc1)N1CCN(CC[C@@H]2OCCc3cc(ccc23)C(N)=O)CC1
COc1ccc(cc1)N1CCN(CCC2OCCc3cc(ccc23)C(N)=O)CC1
COc1ccc2[nH]cc(C3CC3N)c2c1
N[C@H]1C[C@@H]1c1c[nH]c2ccccc12
NC1CC1c1c[nH]c2ccc(F)cc12
COc1cccc2[nH]cc(C3CC3N)c12
CC(CN)c1c[nH]c2ccccc12
N[C@@H]1C[C@H]1c1c[nH]c2ccccc12
COc1ccc2[nH]cc(C(C)CN)c2c1
NC1CC1c1c[nH]c2ccccc12
CN1CNC(=O)C11CCN(CCCC(=O)c2ccc(F)cc2)CC1
CC(C)NC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)C(N)=O
CCN1CN(C)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
NC(=O)C1(N)CCN(CCCC(=O)c2ccc(F)cc2)CC1
CC(C)N1CNC(=O)C11CCN(CCCC(=O)c2ccc(F)cc2)CC1
CN1CNC(=O)C11CCN(CCCOc2ccc(F)cc2)CC1
CCN1CNC(=O)C11CCN(CCCC(=O)c2ccc(F)cc2)CC1
CNC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)C(N)=O
CN1CN(C)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
CCCN1CN(C)C2(CCN(CCCOc3ccc(F)cc3)CC2)C1=O
NC(=O)C1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1
Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)C1CCCCC1
CCCCN1CN(C)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
CCCN1CN(C)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
CC(C)N1CN(C)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)NCNC2=O
CN1CN(Cc2ccccc2)C(=O)C11CCN(CCCC(=O)c2ccc(F)cc2)CC1
CC(N)Cc1c2ccoc2c(Br)c2ccoc12
CNC(=O)C1C(C(C(=O)NCCCN2CCC(CC2)(C(=O)OC)c2ccccc2)=C(C)N=C1C)c1ccc(cc1)[N+]([O-])=O |c:33,t:30|
Fc1ccc(OC[C@@H]2CC[C@H]3CN(CCN3C2)c2ncc(F)cn2)cc1
Cc1ccc(cc1C)N1CCN(CC[C@H]2NC(=O)c3ccccc23)CC1
Cc1ccc(cc1C)N2CCN(CC2)CC[C@H]3c4ccccc4C(=O)N3
Cn1c2CCN(C\C=C/CCc3ccccc3)Cc2c2ccccc12
OCc1coc2cc(OCCCN3CCC(CC3)C(=O)c3ccc(F)cc3)ccc2c1=O
OCc1cc(=O)c2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2o1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3c(c2)occ(C=O)c3=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3c(c2)occc3=O)CC1
OC(=O)c1coc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2c1=O
COCc1coc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2c1=O
Cc1coc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2c1=O
Cc1coc2cc(OCCCN3CCC(CC3)C(=O)c3ccc(F)cc3)ccc2c1=O
CC1CN(CCN1CCCn1nc2ccccn2c1=O)c1cccc(Cl)c1
CCC1CN(CCN1CCCn1nc2ccccn2c1=O)c1cccc(Cl)c1
CC(CN1CCN(CC1)c1cccc(Cl)c1)Cn1nc2ccccn2c1=O
C[C@H]1CN(CCN1CCCn1nc2ccccn2c1=O)c1cccc(Cl)c1
CC(CCn1nc2ccccn2c1=O)N1CCN(CC1)c1cccc(Cl)c1
C[C@@H]1CN(CCN1CCCn1nc2ccccn2c1=O)c1cccc(Cl)c1
COc1cc2OC[C@H]3[C@H](CN4CCN(Cc5ccc6ccccc6c5)CC4)ON=C3c2cc1OC |c:31|
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)OCc1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C(C)Oc1c(OC)cccc1C(C)C
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C(C)(C)Oc1c(OC)cccc1C(C)C
COc1cc2nc(nc(N)c2cc1OC)N(C)Cc1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(Cc2ccccc2)CC1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)CCC(=O)c1ccccc1
COc1ccc(C[C@@H](C)Nc2nc(N)c3cc(OC)c(OC)cc3n2)cc1S(N)(=O)=O
COc1ccccc1OCC(=O)N1CCN(CC1)c1nc(N)c2cc(OC)c(OC)cc2n1
COc1cc2CCN(Cc2cc1OC)c1nc(N)c2cc(OC)c(OC)cc2n1
COc1cc2c(cc1OC)nc(nc2N)N3CCNCC3
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)COc1c(OC)cccc1C(C)C
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)CC(=O)c1ccccc1
COc1cccc(OC)c1OCC(=O)N1CCN(CC1)c1nc(N)c2cc(OC)c(OC)cc2n1
COc1cc2nc(nc(N)c2cc1OC)N1CCC(CC1)(c1ccccc1)c1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CC[N+]([O-])(Cc2ccccc2)CC1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)CC(c1ccccc1)c1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C(C)(C)C
COc1ccccc1OC(C)(C)C(=O)N1CCN(CC1)c1nc(N)c2cc(OC)c(OC)cc2n1
COc1cc2nc(nc(N)c2cc1OC)N1CCc2c(C1)ccc1ccccc21
COc1cc2nc(nc(NC(C)=O)c2cc1OC)N1CCN(CC1)C(C)=O
COc1cc2OC[C@H]3[C@H](CN4CCN(C\C=C\c5ccccc5)CC4)ON=C3c2cc1OC |c:28|
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)c1ccco1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(C)=O
COc1cc2nc(nc(N)c2cc1OC)N(C)CCC(c1ccccc1)c1ccccc1
COc1cc2nc(nc(N)c2cc1OC)N1CCc2ccccc2C1
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(c1ccccc1)c1ccccc1
COc1cc2OC[C@H]3[C@H](CN4CCN(C\C=C(/C)c5ccccc5)CC4)ON=C3c2cc1OC |c:29|
COc1cc2OC[C@H]3[C@H](CN4CCN(C\C(C)=C\c5ccccc5)CC4)ON=C3c2cc1OC |c:29|
C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccccc2)C1
CNS(=O)(=O)Cc1ccc2[nH]cc(CCN3CC[C@@H](CNCc4ccccc4)C3)c2c1
C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(C[C@H]4COC(=O)N4)cc23)C1)c1ccccc1
O=C1N[C@@H](Cc2ccc3[nH]cc(CCN4CC[C@@H](CNCc5ccccc5)C4)c3c2)CO1
CN(C)CCc1c[nH]c2sccc12
CN(C)CCc1c[nH]c2ccsc12
C[C@H](N)Cn1ncc2ccc(O)cc12
COc1ccc2cnn(C[C@H](C)N)c2c1
C[C@H](N)Cn1ncc2ccc(O)c(F)c12
C[C@H](N)Cn1ncc2ccc(O)c(C)c12
COc1ccc2[nH]cc(CC(C)N)c2c1
NCCn1ncc2ccc(O)cc12
CC(N)Cc1c[nH]c2ccc(O)cc12
C[C@@H](N)Cn1ncc2ccc(O)cc12
C[C@H](N)Cn1ncc2ccc(O)c(I)c12
C[C@H](N)Cn1ncc2ccc(O)c(Cl)c12
Clc1ccc(cc1)C1CCN(CCCCN2C(=O)c3ccccc3S2(=O)=O)C1
O=C1N(CCCCN2CCC(C2)c2ccccc2)Cc2ccccc12
Fc1ccc(cc1)C1CCN(CCCCN2C(=O)c3ccccc3S2(=O)=O)C1
O=C1N(CCCCN2CCC(C2)c2ccccc2)S(=O)(=O)c2ccccc12
O=C(N1CCCCC1)c1cccc(CN2CCC(C2)c2ccccc2)c1
Clc1ccc(cc1)C1CCN(Cc2cccc(c2)C(=O)N2CCCCC2)C1
Clc1ccc(cc1)C1CCN(CCCCN2Cc3ccccc3C2=O)C1
OC1(CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccc(Cl)cc1
CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(OS(=O)(=O)C(F)(F)F)cc12 |t:8|
CN1CCN(CC1)C1=Nc2ccccc2Oc2ccc(OS(C)(=O)=O)cc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(OS(C)(=O)=O)ccc2Nc2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2ccccc2Oc2ccc(OS(=O)(=O)C(F)(F)F)cc12 |t:8|
CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(OS(C)(=O)=O)cc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(OS(=O)(=O)C(F)(F)F)cc12 |t:8|
COc1ccccc1N1CCC(CNCC2COc3ccc(Cl)cc3O2)CC1
O=c1ccc2ccc(CNCCNc3ccccc3)cc2o1
Nc1cccc(n1)-c1ccc(CCN2CCN(CC2)c2cccc3cccnc23)cc1
COc1ccc2[nH]cc(C[C@@H]3CCCN3C)c2c1
CN1CCC[C@H]1Cc1c[nH]c2cc(O)ccc12
COc1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1
CN1CCC[C@@H]1Cc1c[nH]c2cc(O)ccc12
COc1ccc2[nH]cc(C3CCN(C)C3)c2c1
OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
COc1cc(C(C)C)c(Oc2cnc(N)nc2N)cc1I
COc1ccc2[nH]c(c(CCN(C)C)c2c1)-c1ccccc1
CN1CCN(CC1)c1nc(Cl)cc(n1)-c1ccc(C)cc1
CN1CCN(CC1)c1cc(nc(Cl)n1)-c1ccc(C)cc1
CN1CCN(CC1)c1cc(nc(Cl)n1)-c1cccs1
CN1CCN(CC1)c1nccc(n1)-n1ccnc1
CN1CCN(CC1)c1nc(Cl)cc(n1)-c1ccoc1
CN1CCN(CC1)c1cc(nc(Cl)n1)-c1ccco1
CN1CCN(CC1)c1nc(Cl)cc(n1)-c1cccs1
CN1CCN(CC1)c1cc(ncn1)-n1ccnc1
CC1CCc2cc(F)cc3c(CCN)c(C)n1c23
Cc1c(CCN)c2cccc3CCCn1c23
C[C@@H]1OC(=O)N([C@H]1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)c1ccc(F)cc1 |r|
CC(C)NC1COc2cccc(C(N)=O)c2C1
CCCN(C1CCCC1)C1COc2cccc(C(N)=O)c2C1
CCCN(CCC)C1COc2cccc(C(=O)NC(C)C)c2C1
CCCNC1COc2cccc(C(N)=O)c2C1
CCCN(C(C)C)C1COc2cccc(C(N)=O)c2C1
CCCN(CC(C)C)C1COc2cccc(C(=O)NC)c2C1
COc1cc(CC(C)N)c(OC)cc1CCCc1ccccc1
COc1c(CCCc2ccccc2)ccc(CC(C)N)c1OC
COc1ccccc1CC(C)N
COc1cc(CC(C)N)cc(OC)c1Br
COc1cc(CC(C)N)cc(OC)c1
COc1cccc(OC)c1CC(C)N
COc1cc(CCCCc2ccccc2)c(OC)cc1CCN
COc1cc(CCc2ccccc2)c(OC)cc1CCN
COc1cc(CC(C)N)ccc1CCCc1ccccc1
NCCc1ccc(CCCc2ccccc2)cc1
COc1cc(CCCc2ccccc2)c(OC)cc1CCN
COc1cc(CC(C)N)c(OC)cc1CCCCc1ccccc1
COc1ccc(CCCc2cc(OC)c(CC(C)N)cc2OC)cc1
COc1ccc(OC)c(CCN)c1
COc1cc(CC(C)N)cc(OC)c1CCCc1ccccc1
COc1cc(CC(C)N)c(OC)cc1CCc1ccccc1
CC(N)Cc1ccc(CCCc2ccccc2)cc1
COc1cccc(CC(C)N)c1OC
COc1cccc(CC(C)N)c1
COc1cc(CC(C)N)c(OC)cc1CCCc1ccc(Cl)cc1
COc1cc(CCCc2ccccc2)ccc1CC(C)N
COc1cc(CCCc2ccccc2)cc(OC)c1CC(C)N
COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1
CCN(CC)CCc1c[nH]c2cc(F)ccc12
CCN(CC)CCc1c[nH]c2cccc(O)c12
CCN(CC)CCc1c[nH]c2ccccc12
CN(C)CCc1c[nH]c2cc(F)cc(O)c12
COc1cc2c(CCN(C)C)c[nH]c2cc1F
CN(C)CCc1c[nH]c2c(F)ccc(O)c12
COc1ccc2[nH]cc(CCN(C)C)c2c1F
CCN(CC)CCc1c[nH]c2ccc(OC)cc12
C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCCC1
CCN(C)CCc1c([nH]c2ccccc12)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
CN(C)CCc1c([nH]c2ccccc12)-c1ccccc1
CCN(CC)CCc1c([nH]c2ccccc12)-c1ccccc1
CCN(C)CCc1c([nH]c2ccccc12)-c1cccs1
CCN(C)CCc1c([nH]c2ccccc12)-c1cccc(c1)[N+]([O-])=O
CCN(C)CCc1c([nH]c2ccccc12)-c1ccccc1F
CCN(C)CCc1c([nH]c2ccccc12)-c1cccc(c1)C(F)(F)F
CCN(C)CCc1c([nH]c2ccccc12)-c1ccc(F)cc1
CCN(C)CCc1c([nH]c2ccccc12)-c1ccccc1
CCN(C)CCc1c([nH]c2ccccc12)-c1cccc(F)c1
CCN(C)CCc1c([nH]c2ccccc12)-c1ccc(Cl)cc1
C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1
CCN(C)CCc1c([nH]c2ccccc12)-c1ccc(cc1)C#N
COC[C@H]1CCCN1CCc1c([nH]c2ccccc12)-c1ccccc1
C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCC1
C[C@H]1CCCCN1CCc1c([nH]c2ccccc12)-c1ccccc1
COC[C@@H]1CCCN1CCc1c([nH]c2ccccc12)-c1ccccc1
CCN(C)CCc1c([nH]c2ccccc12)-c1ccco1
C[C@@H]1CCCCN1CCc1c([nH]c2ccccc12)-c1ccccc1
C1CC2CC(CC1N2)c1c([nH]c2ccccc12)-c1ccccc1 |TLB:8:4:7:0.1|
C(Cc1ccccc1)N1CCC(CC1)c1c([nH]c2ccccc12)-c1ccccc1
C(N1CCC(CC1)c1c([nH]c2ccccc12)-c1ccccc1)c1ccccc1
C1CC(CCN1)c1c([nH]c2ccccc12)-c1ccccc1
O=C1NCCN1CCN1CCC(CC1)c1c([nH]c2ccccc12)-c1ccccc1
CN1CCC(CC1)c1c([nH]c2ccccc12)-c1ccccc1
NCC1c2ccccc2Oc2ccccc12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccccc2-c2ccccc-12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1\c2ccccc2-[#8]-c2ccccc-12
NCC1c2ccccc2C=Cc2ccccc12 |c:10|
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1\c2ccccc2-[#6]-c2ccccc-12
NCC1c2ccccc2CCc2ccccc12
NCC1c2ccccc2-c2ccccc12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\[#6])-c1ccccc1
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1\c2ccccc2-[#16]-c2ccccc-12
NCC1c2ccccc2Sc2ccccc12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccccc1)-c1ccccc1
NCCCN1c2ccccc2CCc2ccccc12
C[N+](C)(C)CC1c2ccccc2Cc2ccccc12
NC1c2ccccc2Cc2ccccc12
C(NCc1ccccc1)C1c2ccccc2Cc2ccccc12
COc1ccc2c(c1F)c(c[nH]2)CCN3CCCC3
C[C@@H]([NH3+])Cc1c2ccoc2c(Br)c2ccoc12
C[C@H]([NH3+])Cc1c2ccoc2c(Br)c2ccoc12
C[C@@H]([NH3+])Cc1c2CCOc2c(c2CCOc12)C(F)(F)F
COc1ccc(OC)c(C[C@@H](C)N)c1
C[C@H]([NH3+])Cc1c2ccoc2cc2ccoc12
C[C@@H]([NH3+])Cc1c2CCOc2c(Br)c2CCOc12
C[C@@H]([NH3+])Cc1c2ccoc2cc2ccoc12
C[C@H]([NH3+])Cc1c2CCOc2cc2CCOc12
C[C@H]([NH3+])Cc1c2CCOc2c(Br)c2CCOc12
C[C@H]([NH3+])Cc1c2CCOc2c(c2CCOc12)C(F)(F)F
C[C@@H]([NH3+])Cc1c2CCOc2cc2CCOc12
C[C@H]([NH3+])Cc1c2ccoc2c(c2ccoc12)C(F)(F)F
C[C@@H]([NH3+])Cc1c2ccoc2c(c2ccoc12)C(F)(F)F
F[C@@H]1CCNCC1c1c([nH]c2ccc(F)cc12)-c1ccccc1
F[C@@H]1CCNCC1c1c[nH]c2cc(F)ccc12
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1ccsc1
C1CNCC(C1)c1c([nH]c2ccccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2ccc(Cl)cc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)C1CCCCC1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1ccc(F)cc1
CN1CCCCC1c1c([nH]c2ccccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2c(Cl)cccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1cccc2ccccc12
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2c(F)cccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1cccnc1
COC(=O)c1[nH]c2cc(F)ccc2c1C1CNCC[C@H]1F
CN1CCCC(C1)c1c([nH]c2ccccc12)-c1ccccc1
CN1CCN(C)C(C1)c1c([nH]c2ccccc12)-c1ccccc1
C1COC(CN1)c1c([nH]c2ccccc12)-c1ccccc1
O[C@@H]1CCNCC1c1c([nH]c2ccccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(Cl)ccc12)-c1ccccc1
O=C1NCCN1CCN1CCCC(C1)c1c([nH]c2ccccc12)-c1ccccc1
C(Cc1ccccc1)N1CCCC(C1)c1c([nH]c2ccccc12)-c1ccccc1
Fc1ccc(cc1)-c1[nH]c2cc(F)ccc2c1C1CCCNC1
F[C@H]1CCNCC1c1c([nH]c2ccccc12)-c1ccccc1
C(N1CCCC(C1)c1c([nH]c2ccccc12)-c1ccccc1)c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1ccoc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)C(=O)Nc1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2ccccc12)-c1ccccc1
F[C@@H]1CCNCC1c1c([nH]c2cc(F)ccc12)-c1ccc2ccccc2c1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C\c3cccnc3)c3ccccc23)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C/c3cccnc3)c3ccccc23)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C/c3cccs3)c3ccccc23)CC1
Clc1ccc(\C=C2/C(=O)N(CCCN3CCN(CC3)c3cccc(Cl)c3)c3ccccc23)cc1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C\c3cccs3)c3ccccc23)CC1
Clc1ccc(\C=C2\C(=O)N(CCCN3CCN(CC3)c3cccc(Cl)c3)c3ccccc23)cc1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C/c3ccccc3)c3ccccc23)CC1
COc1ccc(\C=C2\C(=O)N(CCCN3CCN(CC3)c3cccc(Cl)c3)c3ccccc23)cc1
COc1ccc(\C=C2/C(=O)N(CCCN3CCN(CC3)c3cccc(Cl)c3)c3ccccc23)cc1
Clc1cccc(c1)N1CCN(CCCN2C(=O)Cc3ccccc23)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)\C(=C\c3ccccc3)c3ccccc23)CC1
c1cc2c(c[nH]c2nc1)CN3CCN(CC3)c4ccc(cc4)Cl
Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
CSc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
COc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
COc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1
C=Cc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
Fc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1
FC(F)(F)c1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
CCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
C(N1CCN(CC1)c1ccc(cc1)-c1ccccc1)c1c[nH]c2ncccc12
CCCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
COc1ccccc1N1CCN(CCC(Oc2cccc3ccccc23)c2ccsc2)CC1
COc1ccccc1N1CCN(CCC(O)c2csc3ccccc23)CC1
COc1ccccc1N1CCN(CCC(=O)c2csc3ccccc23)CC1
COc1ccc(CCc2ccccc2)cc1CCN
COc1ccc(OCCc2ccc(Br)cc2)cc1CCN
COc1cc(ccc1CCN)C#CCCCc1ccccc1
COc1cc(Cc2ccccc2)ccc1CCN
COc1ccc(CCCc2ccccc2)cc1CC(C)N
COc1ccc(cc1CCN)C#CCCCc1ccccc1
COc1ccc(CCCc2ccccc2)cc1CCN
COc1cc(CCCC2CCCCC2)ccc1CCN
COc1ccc(CCCC2CCCCC2)cc1CCN
COc1cc(CCCc2ccccc2)ccc1CCN
COc1ccc(CCCCc2ccccc2)cc1CCN
COc1ccc(OCCc2ccccc2)cc1CCN
COc1ccccc1CCN
COc1cc(CCc2ccccc2)ccc1CCN
COc1cc(OCCc2ccccc2)ccc1CCN
COc1cc(CCCCCc2ccccc2)ccc1CCN
COc1cc(CCCCc2ccccc2)ccc1CCN
COc1ccc(I)cc1CCN
COc1ccc(cc1CCN)-c1ccccc1
COc1ccc(Br)cc1CCN
COc1ccc(OCc2ccccc2)cc1CCN
COc1ccc(O)cc1CCN
COc1cc(ccc1CCN)-c1ccccc1
COc1ccc(Cc2ccccc2)cc1CCN
COc1ccc(CCCCCc2ccccc2)cc1CCN
CN(C)CCc1cccc2n(c(cc12)C(=O)c1ccccc1)S(=O)(=O)c1ccccc1
CN(C)CCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1
CCOC(=O)c1[nH]c2ccccc2c1CCN(C)C
NCCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
CN(C)CCc1cn(C(=O)c2ccccc2)c2ccc(O)cc12
CN(C)CCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
CN(C)[C@H]1Cc2cn(c3cccc([C@@H]1O)c23)S(=O)(=O)c1ccc(C)cc1
CC(N)Cc1c[nH]c2ccc3ccccc3c12
CC(N)Cn1ccc2ccc3ccccc3c12
Cc1c2CNCCn2c2ccc(Cl)cc12
CC(CN)n1ccc2ccc3ccccc3c12
COc1ccc2ccn(CCN(C)C)c2c1
COC1Cc2ccccc2C2(CCN(Cc3ccccc3)CC2)O1
COC1Cc2ccccc2C2(CCN(CCCc3ccccc3)CC2)O1
COC1OC2(CCN(Cc3ccccc3)CC2)c2ccccc12
NCC1CC2c3ccccc3C1c1ccccc21 |TLB:9:10:12.17:2.3,13:12:10.5:2.3,THB:1:2:10.5:12.17,(8.57,-3.6,;6.87,-4.28,;6.57,-5.83,;5.98,-6.61,;6.66,-8.59,;5.03,-9.2,;3.34,-9.89,;1.92,-9.4,;2.19,-8.22,;3.86,-7.54,;5.29,-8.02,;6.99,-7.35,;8.41,-7.84,;10.09,-7.17,;11.51,-7.65,;11.24,-8.83,;9.57,-9.51,;8.14,-9.01,)|
N1C2C1C1c3ccccc3C2c2ccccc12 |TLB:15:16:2.1:4.9,5:4:2.1:11.16,THB:0:2:4.9:11.16,0:1:4.9:11.16,(13.37,-10.09,;10.87,-11.51,;11.39,-10.6,;11.39,-11.98,;9.66,-12.67,;8.2,-12.17,;6.5,-12.87,;6.22,-14.06,;7.67,-14.56,;9.39,-13.87,;11.05,-13.25,;12.57,-13.66,;14.02,-14.18,;15.73,-13.48,;16,-12.28,;14.55,-11.8,;12.84,-12.48,)|
NCC12CC(c3ccccc13)c1ccccc21 |TLB:15:16:10.5:3,9:10:16.11:3|
CC1(CN)c2ccccc2Cc2ccccc12
C1NCc2cccc3Cc4ccccc4C1c23
NCCc1ccccc1Cc1ccccc1
NCc1c2ccccc2cc2ccccc12
NCC1Cc2ccccc2-c2ccccc12
NCC1CCCc2ccccc12
NC1CC2c3ccccc3C1c1ccccc21 |TLB:0:1:11.16:9.4,8:9:11.16:1.2,12:11:9.4:1.2,(13.37,-10.09,;11.39,-10.6,;10.64,-11.69,;11.05,-13.25,;12.57,-13.66,;14.02,-14.18,;15.73,-13.48,;16,-12.28,;14.55,-11.8,;12.84,-12.48,;11.39,-11.98,;9.66,-12.67,;8.2,-12.17,;6.5,-12.87,;6.22,-14.06,;7.67,-14.56,;9.39,-13.87,)|
CC(N)C1c2ccccc2Cc2ccccc12
CC1(C)c2ccccc2C(CN)c2ccccc12
NCC12CCC(c3ccccc13)c1ccccc21 |TLB:16:17:11.6:3.4,10:11:17.12:3.4,(13.29,-10.03,;11.57,-10.72,;11.32,-11.9,;10.9,-10.36,;10.3,-11.14,;10.99,-13.17,;12.49,-13.58,;13.93,-14.09,;15.63,-13.4,;15.9,-12.2,;14.46,-11.72,;12.76,-12.41,;9.33,-13.78,;7.63,-14.47,;6.18,-13.98,;6.46,-12.79,;8.15,-12.09,;9.6,-12.59,)|
Cn1c2ccc(CCN3CCN(Cc4ccccc4)CC3)cc2sc1=O
Cn1c2ccc(CCN3CCC(Cc4ccccc4)CC3)cc2sc1=O
Cn1c2ccc(CCCCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)cc2sc1=O
Cn1c2ccc(CCCCN3CCC(Cc4ccccc4)CC3)cc2sc1=O
Cn1c2ccc(CCCCN3CCN(Cc4ccc(Cl)cc4Cl)CC3)cc2sc1=O
Cn1c2ccc(CCN3CCN(Cc4ccc(Cl)cc4Cl)CC3)cc2sc1=O
C[C@H]1CN(CCc2ccc3n(C)c(=O)sc3c2)C[C@@H](C)N1
Cn1c2ccc(CCCCN3CCN(Cc4ccccc4)CC3)cc2sc1=O
Cn1c2ccc(CCN3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)cc2sc1=O
C[C@H]1CN(CCCCc2ccc3n(C)c(=O)sc3c2)C[C@@H](C)N1
Cn1c2ccc(CCN3CCC(CC3)c3ccccc3)cc2sc1=O
Cn1c2ccc(CCCCN3CCC(CC3)c3ccccc3)cc2sc1=O
C[C@H]1C[C@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|
C[C@@H]1C[C@@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|
C[C@H]1C[C@@H](C)N1C(=O)[C@H]1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:24|
CN1C(N)=NC(=Cc2c[nH]c3cc(Br)ccc23)C1=O |w:6.6,c:3|
CC\N=C1/N(C)C(=O)\C(=C/c2c[nH]c3ccccc23)N1C
CN1C(=N)N(C)\C(=C\c2c[nH]c3cc(Br)ccc23)C1=O
Fc1ccc(cc1)C(=O)C1CCN(CCc2cccc(I)c2)CC1
OC(C1CCN(Cc2ccccc2I)CC1)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)C1CCN(Cc2cccc(I)c2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1
OC(C1CCN(Cc2cccc(I)c2)CC1)c1ccc(F)cc1
OC(C1CCN(CCc2ccccc2)CC1)c1ccc(cc1)[N+]([O-])=O
Fc1ccc(CCN2CCC(CC2)C(=O)c2ccc(F)cc2)cc1
OC(C1CCN(Cc2ccc(I)cc2)CC1)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)C1CCN(Cc2ccc(I)cc2)CC1
OC(C1CCN(CCc2ccc(I)cc2)CC1)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)C1CCN(Cc2ccccc2I)CC1
[O-][N+](=O)c1ccc(cc1)C(=O)C1CCN(CCc2ccccc2)CC1
OC(C1CCN(CCc2ccc(F)cc2)CC1)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)C1CCN(CCc2ccc(I)cc2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCc2ccccc2I)CC1
OC(C1CCN(CCc2ccccc2I)CC1)c1ccc(F)cc1
OC(C1CCN(CCc2cccc(I)c2)CC1)c1ccc(F)cc1
CN1CCN2C(C1)c1ccccc1Cc1cccc(O)c21
COc1cccc2Cc3ccccc3[C@H]3CN(C)CCN3c12
COc1cccc2Cc3ccccc3C3CN(C)CCN3c12
COc1cccc2Cc3ccccc3[C@@H]3CN(C)CCN3c12
CN1CCN2C(C1)c1ccccc1Cc1cccc(OS(=O)(=O)C(F)(F)F)c21
COc1cc(C)cc(OC)c1CC(C)N
CC(N)Cc1c2occc2c(C)c2ccoc12
CC(N)Cc1c2OCCc2c(C)c2CCOc12
COc1ccccc1CNCCc1cc(OC)c(I)cc1OC
CN1CCN=C1Cc1cccnc1 |c:4|
COc1ccc(Cc2c(N)nc(SCCN3CCN(Cc4ccc(C)cc4)CC3)nc2N)cc1
Nc1nc(SCCN2CCN(Cc3ccccc3Cl)CC2)nc(N)c1Cc1ccccc1Cl
COc1ccccc1Cc1c(N)nc(SCCN2CCN(Cc3cccc(c3)C(F)(F)F)CC2)nc1N
COc1ccc(Cc2c(N)nc(SCCN3CCN(Cc4ccccc4C)CC3)nc2N)cc1
COc1ccc(Cc2c(N)nc(SCCN3CCN(Cc4ccccc4Cl)CC3)nc2N)cc1
COc1cccc(Cc2c(N)nc(SCCN3CCN(Cc4cccc(c4)C(F)(F)F)CC3)nc2N)c1
CCOc1ccccc1Cc1c(N)nc(SCCN2CCN(Cc3cccc(c3)C(F)(F)F)CC2)nc1N
Nc1nc(SCCN2CCN(Cc3ccccc3C(F)(F)F)CC2)nc(N)c1Cc1ccccc1
COc1ccccc1Cc1c(N)nc(SCCN2CCN(Cc3ccccc3C(F)(F)F)CC2)nc1N
COc1cc(Cc2c(N)nc(SCCN3CCN(Cc4ccccc4Cl)CC3)nc2N)cc(OC)c1OC
Nc1nc(SCCN2CCN(Cc3ccccc3Cl)CC2)nc(N)c1Cc1ccccc1O
Nc1nc(SCCN2CCN(Cc3cccc(c3)C(F)(F)F)CC2)nc(N)c1Cc1ccccc1O
Nc1nc(SCCN2CCN(Cc3ccccc3Cl)CC2)nc(N)c1Cc1ccccc1
CC(C)Oc1ccccc1Cc1c(N)nc(SCCN2CCN(Cc3cccc(c3)C(F)(F)F)CC2)nc1N
Clc1ccc2Nc3ncccc3N=C(N3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Cc1ccc2Nc3ncccc3N=C(N3CCN(CC3)c3ccccc3)c2c1 |t:13|
CN(C)CCCNC1=Nc2cccnc2Nc2ccc(C)cc12 |t:7|
Cc1ccc2Nc3ncccc3N=C(N3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(NCCN3CCCC3)c2c1 |t:13|
Cc1ccc2Nc3ncccc3N=C(NC3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(NC3CC4CCC(C3)N4Cc3ccccc3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(NCCN3CCCCC3)c2c1 |t:13|
CN1CCCC1CCNC1=Nc2cccnc2Nc2ccc(C)cc12 |t:10|
Cc1ccc2Nc3ncccc3N=C(NCCN3CCOCC3)c2c1 |t:13|
Cc1ccc2Nc3ncccc3N=C(N3CCN(CC3)C3CCCCC3)c2c1 |t:13|
CN1CCCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12 |t:9|
Cc1ccc2Nc3ncccc3N=C(N3CCN(CCc4ccccc4)CC3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(NC3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(N3CCN(CCc4ccccc4)CC3)c2c1 |t:13|
Cc1ccc2Nc3ncccc3N=C(NC3CC4CCC(C3)N4Cc3ccccc3)c2c1 |t:13|
Clc1ccc2Nc3ncccc3N=C(N3CCN(CC3)C3CCCCC3)c2c1 |t:13|
Cc1ccc2Nc3ncccc3N=C(N3CCN(CC3)c3cccc(Cl)c3)c2c1 |t:13|
CN1CCC(CC1)NC1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:9|
Clc1ccc2Nc3ncccc3N=C(N3CCN(CC3)c3ccccc3)c2c1 |t:13|
CN(C)CCNC1=Nc2cccnc2Nc2ccc(C)cc12 |t:6|
FC(F)(F)c1cccc(c1)N1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:18|
Clc1cccc(c1)N1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:15|
CN1CCC(CC1)NC1=Nc2cccnc2Nc2ccc(C)cc12 |t:9|
CCCN1CCC(COc2nc3ccccc3c3NCCCc23)CC1
Oc1ccccc1C(=O)CCCCCN1CCN(CC1)c1noc2ccccc12
COc1ccccc1C(=O)CCCCCN1CCN(CC1)c1noc2ccccc12
Nc1cc(O)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3SCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3OCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3CCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3OCCN2c13
CNc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3CCCN2c13
Fc1ccc(C(=O)CCCN2CC[C@H]3[C@@H](C2)c2cccc4SCCCN3c24)c(NC=O)c1
Nc1ccccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3CCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3SCCCN2c13
Nc1cc(Br)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3CCCCN2c13
O=C(CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13)c1ccccc1
CS(=O)(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1c(F)cccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3CCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3OCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3SCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3CCCCN2c13
Fc1ccc(cc1)C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccc(F)cc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3CCCN2c13
CC(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3OCCN2c13
Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCN2c13
Nc1cc(Cl)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
CCOC(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
Nc1ccccc1C(=O)CCCN1CC[C@@H]2[C@H](C1)c1cccc3CCCCN2c13
CCNC(=O)Nc1cc(F)ccc1C(=O)CCCN1CC[C@H]2[C@@H](C1)c1cccc3SCCCN2c13
O=C1CN(CN2CCN(CC2)c2cccc3ccccc23)C(=O)C2CCCN12
CNCCc1c[nH]c2c1cccc2
CCNCCc1c[nH]c2ccccc12
Cn1cc(c2c1cccc2)CCN
NCCc1c[nH]c2cccc(F)c12
COc1cccc2[nH]cc(CCN)c12
c1cc2c(cc1Cl)c(c[nH]2)CCN
c1cc2c(cc1F)c(c[nH]2)CCN
NCCc1c[nH]c2cc(F)ccc12
COc1ccc2c(c1)[nH]cc2CCN
Cc1ccc2c(CCN)c[nH]c2c1
Cc1cccc2c(CCN)c[nH]c12
NCCc1c[nH]c2c(Cl)cccc12
COc1cccc2c(CCN)c[nH]c12
CC(N)Cc1c[nH]c2ccccc12
CC(N)Cc1c[nH]c2ccc(Cl)cc12
CC(N)Cc1c[nH]c2ccc(F)cc12
CCC(N)Cc1c[nH]c2ccccc12
CC[C@@H](N)Cc1c[nH]c2ccccc12 |r|
CCC(N)Cc1c[nH]c2ccc(Cl)cc12
CCC(N)Cc1c[nH]c2ccc(F)cc12
C1Cc2[nH]c3ccccc3c2CCN1
CCOc1ccccc1-c1ccc2N3CCNCCC3Cc2c1
CCOc1ccc(cc1)-c1cc(Cl)cc2CC3CCNCCN3c12
N#Cc1c2CCNCCn2c2ccccc12
NC(=O)C(=O)c1c2CCNCCn2c2ccccc12
C1Cn2c3CCNCCc3c3cccc(O1)c23
CN1CCc2cc3ccccc3n2CC1
CCOc1ccccc1-c1cc(Cl)cc2cc3CCNCCn3c12
Cc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12
Fc1ccccc1-c1cc(Cl)cc2CC3CCNCCN3c12
CCCN1CCc2cc3ccccc3n2CC1
CCOc1cccc(c1)-c1cc(Cl)cc2CC3CCNCCN3c12
CCOc1ccccc1-c1ccc2CC3CCNCCN3c2c1
Clc1ccc(c(Cl)c1)-c1cc(Cl)cc2CC3CCNCCN3c12
COc1ccc(Cl)cc1-c1cc(Cl)cc2CC3CCNCCN3c12
Clc1ccccc1-c1cccc2CC3CCNCCN3c12
Clc1cc2CC3CCNCCN3c2c(c1)-c1ccccc1Cl
NC(=O)c1c2CCNCCn2c2ccccc12
Clc1ccc(Cl)c(c1)-c1cc(Cl)cc2CC3CCNCCN3c12
O=Cc1c2CCNCCn2c2ccccc12
Clc1c2CCNCCn2c2ccccc12
Fc1ccc(cc1)-c1cc(Cl)cc2CC3CCNCCN3c12
C1Cc2cc3ccccc3n2CCN1
Cc1c2CCNCCn2c2ccccc12
FC(F)(F)C(=O)c1c2CCNCCn2c2ccccc12
CCN1CCc2cc3ccccc3n2CC1
Cn1c2CCNCCc2c2ccccc12
C1C2CCNCCN2c2ccccc12
CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)nc12
CCC(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
NCC1c2ccccc2Cc2cc(CCCc3ccccc3)ccc12
CCCCCCc1ccc2C(CN)c3ccccc3CCc2c1
NCC1c2ccccc2Cc2cc(Br)ccc12
COc1ccc2C(CN)c3ccccc3Cc2c1
NCC1c2ccccc2CCc2cc(Br)ccc12
COc1ccc2C(CN)c3ccccc3CCc2c1
NCC1c2ccccc2CCc2cc(CCCc3ccccc3)ccc12
CCCCCCc1ccc2C(CN)c3ccccc3Cc2c1
COc1cc(Br)c2OC[C@H]3CC[C@@H](CN)c1c23
COc1cc(Br)c2occ3CC[C@@H](CN)c1c23
COc1cc(Br)c2OC[C@@H]3CC[C@@H](CN)c1c23
COc1ccc2OC[C@@H]3CC[C@@H](CN)c1c23
COc1ccc2OC[C@H]3CC[C@@H](CN)c1c23
COc1ccc2occ3CC[C@@H](CN)c1c23
C(COc1ccccc1)CN1CCc2c(C1)[nH]c1ccccc21
C(COc1ccccc1)CN1CCc2[nH]c3ccccc3c2C1
COc1cccc2c3CN(CCCOc4ccc(F)cc4)CCc3n(C)c12
Cn1c2CCN(CCCOc3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCCCCc3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCCc3ccc(F)cc3)Cc2c2ccccc12
Cn1c2CCN(CCCC(O)c3ccc(F)cc3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3ccc(cc3)[N+]([O-])=O)Cc2c2ccccc12
Cn1c2CCN(CCOc3ccc(F)cc3)Cc2c2ccccc12
Cn1c2CN(CCCOc3ccccc3)CCc2c2ccccc12
Cn1c2CCNCc2c2ccccc12
Cn1c2CCN(CCCC(=O)c3ccc(F)cc3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3cccc4ccccc34)Cc2c2ccccc12
Cn1c2CCN(CCCOCc3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCCCc3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3ccc(F)cc3)Cc2c2ccccc12
C(COc1ccccc1)CN1CCc2c(C1)c1ccccc1n2Cc1ccccc1
Cn1c2CCN(CCCOc3ccc4ccccc4c3)Cc2c2ccccc12
O=C(CCCN1CCc2c(C1)[nH]c1ccccc21)c1ccccc1
Cn1c2CCN(CCCOc3ccc(Cl)c(Cl)c3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3ccc(N)cc3)Cc2c2ccccc12
CCn1c2CCN(CCCOc3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3ccc(Cl)cc3)Cc2c2ccccc12
Cn1c2CCN(C\C=C\CCc3ccccc3)Cc2c2ccccc12
COc1ccc2n(C)c3CCN(CCCOc4ccc(F)cc4)Cc3c2c1
Cn1c2CCN(CCCC(N=O)c3ccc(F)cc3)Cc2c2ccccc12
COc1ccc(CCCCN2CCc3c(C2)c2ccccc2n3C)cc1
Cn1c2CCN(CCCC(=O)c3ccccc3)Cc2c2ccccc12
Cn1c2CCN(CCCOc3ccc(F)cc3)Cc2c2cccc(Cl)c12
COc1ccc(OCCCN2CCc3c(C2)c2ccccc2n3C)cc1
Cn1c2CCN(CCCOc3ccc(F)cc3)Cc2c2cc(Cl)ccc12
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1cc2ccccc2o1
Cc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1C
COc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
Cc1cccc(n1)N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cc2ccccc2o1
Fc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3[nH]2)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2c[nH]c3ccccc23)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3n2C)CC1
Cc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1cc2ccccc2cn1
Cc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
O=C(NCCCCN1CCN(CC1)c1ccccn1)c1cc2ccccc2cn1
Cc1cccc(n1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
O=C(NCCCCN1CCN(CC1)c1ncccn1)c1cc2ccccc2cn1
O=C(NCCCCN1CCN(CC1)c1cnc2ccccc2c1)c1cc2ccccc2cn1
Fc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
Fc1ccc(cc1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
Oc1ccc(cc1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1ccc2ccccc2n1
Cc1cccc(c1)N1CCN(CCCCNC(=O)c2ccc3ccccc3n2)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2ccc3ccccc3n2)CC1
O=C(NCCCCN1CCN(CC1)c1ccccn1)c1ccc2ccccc2n1
O=C(NCCCCN1CCN(CC1)c1ccccc1)[C@H]1CCc2ccccc2N1 |r|
Cc1cccc(c1)N1CCN(CCCCNC(=O)[C@H]2CCc3ccccc3N2)CC1 |r|
O=C(NCCCCN1CCN(CC1)c1ccccc1)[C@@H]1CCc2ccccc2N1 |r|
Cc1cccc(c1)N1CCN(CCCCNC(=O)[C@@H]2CCc3ccccc3N2)CC1 |r|
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1ccc2ncccc2c1
Cc1cccc(n1)N1CCN(CCCCNC(=O)c2ccccc2)CC1
COc1cccc(n1)N1CCN(CCCCNC(=O)c2ccccc2)CC1
O=C(NCCCCN1CCN(CC1)c1cccc2ccccc12)c1ccccc1
O=C(NCCCCN1CCN(CC1)c1cnc2ccccc2c1)c1ccccc1
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1ccccn1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2ccccn2)CC1
Cc1cccc(n1)N1CCN(CCCCNC(=O)c2ccccn2)CC1
COc1cccc(n1)N1CCN(CCCCNC(=O)c2ccccn2)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2cccc(C)n2)CC1
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1cccnc1
Brc1cccc2c3CCNCc3[nH]c12
COc1ccc2c(c1)[nH]c1c(C)nccc21
CC(C)Oc1cccc2[nH]c3C=NCCc3c12 |c:11|
COc1cccc2c3CCNCc3[nH]c12
C(Oc1cccc2[nH]c3C=NCCc3c12)c1ccccc1 |c:9|
Brc1cccc2[nH]c3C=NCCc3c12 |c:8|
COc1ccc2[nH]c3c(CCN=C3C)c2c1 |c:11|
Brc1ccc2c3CCNCc3[nH]c2c1
COc1ccc2[nH]c3C=NCCc3c2c1 |c:8|
Brc1cccc2[nH]c3CNCCc3c12
COc1ccc2c3CCN=Cc3[nH]c2c1 |c:9|
Brc1ccc2[nH]c3C=NCCc3c2c1 |c:7|
Brc1ccc2c3CCN=Cc3[nH]c2c1 |c:8|
COc1cccc2c3CCN=Cc3[nH]c12 |c:10|
CC1=NCCc2c1[nH]c1ccccc21 |t:1|
CC(C)Oc1cccc2[nH]c3c(CCN=C3C)c12 |c:14|
COc1ccc2c(c1)c3c([nH]2)CNCC3
Brc1ccc2[nH]c3CNCCc3c2c1
Cl.Cn1c2ncn(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O
Cl.COc1ccccc1N1CCN(CCCn2cnc3n(C)c(=O)n(C)c(=O)c23)CC1
Cl.Cn1c2ncn(CCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O
Cl.COc1ccccc1N1CCN(CCCCn2cnc3n(C)c(=O)n(C)c(=O)c23)CC1
Cl.Cn1c2ncn(CCCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCN3CCN(CC3)c3cccc(Cl)c3Cl)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCN3CCN(CC3)c3ccc(Cl)c(Cl)c3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O
Cl.COc1ccccc1N1CCN(CCCCCn2cnc3n(C)c(=O)n(C)c(=O)c23)CC1
Cl.Cn1c2ncn(CCCCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCN3CCc4ccccc4C3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCN3CCc4ccccc4C3)c2c(=O)n(C)c1=O
Cl.Cn1c2ncn(CCCCCN3CCc4ccccc4C3)c2c(=O)n(C)c1=O
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1ccccc1OC
Cn1c2nc(N3CCOCC3)n(CCCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
CN(C)CCSc1nc(cs1)-c1ccncc1
CN(C)CCSC(C)(C)C
CN(C)CCSc1nc(cs1)-c1ccccc1
CN(C)CCSc1nc2ccccc2s1
CN(C)CCSc1cccc(n1)C1CCCCC1
CN(C)CCSc1cccc(n1)C1(O)CCCCC1
CN(C)CCSc1cccc(n1)-c1ccccc1
CN(C)CCSc1cccc(Br)n1
CN(C)CCSc1nc(cs1)C(C)(C)C
CC(=O)c1cccc(NC(=O)NCCCN2CCC[C@@H](Cc3ccc(F)cc3)C2)c1
COc1cccc(NC(=O)NCCCN2CCCC(CCc3ccccc3)C2)c1
COc1cccc(NC(=O)NCCCN2CCC(Cc3ccc(F)cc3)CC2)c1
O=C(NCCCN1CCC(Cc2ccccc2)CC1)Nc1cccc(c1)C#N
COc1cccc(NC(=O)NCCCN2CCC(Cc3ccccc3)CC2)c1
O=C(NCCCN1CCCC(Cc2ccccc2)C1)Nc1cccc(c1)C#N
Fc1ccccc1CC1CCCN(CCCNC(=O)Nc2cccc(c2)C#N)C1
COc1cccc(NC(=O)NCCCN2CCCC(Cc3ccccc3)C2)c1
Fc1ccc(CC2CCN(CCCNC(=O)Nc3cccc(c3)C#N)C2)cc1
Fc1ccc(CC2CCCN(CCCNC(=O)Nc3cccc(c3)C#N)C2)cc1
Fc1ccc(CC2CCCN(CCCNC(=O)Nc3cccc(c3)C#N)C2)c(F)c1
Fc1ccc(CC2CCN(CCCNC(=O)Nc3cccc(c3)C#N)CC2)cc1
CC(=O)c1cccc(NC(=O)NCCCN2CCC(Cc3ccc(F)cc3)CC2)c1
C1CC(CN1)(c1ccccc1)c1ccccc1
C1CC2(CN1)c1ccccc1CCc1ccccc21
C1CNCC2(C1)c1ccccc1Cc1ccccc21
C1CC(CN1)c1ccccc1
C1CC2(CN1)CCCc1ccccc21
CN1CCc2c(C1)c1cccc3-c4ccccc4CCn2c13
C[C@@H]1Cn2c3CCCCc3c3cccc(CN1)c23
Cc1cc2CNCCn3c4CCCCc4c(c1)c23
Cc1cc2CNCCn3c4CCCc4c(c1)c23
CC1(C)Cc2c(c3cccc4CNCCn2c34)C(C)(C)C1
C1CCc2c(CC1)c1cccc3CNCCn2c13
C1Cc2c(C1)c1cccc3CNCCn2c13
COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Cn1c2nc3n(CCCN4CCN(CC4)c4ccccc4)c(=O)ccn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCN2CCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)CC1
Cn1c2nc3N(CCCCN4CCN(CC4)c4ccccc4)CCCn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCn2c3nc4n(C)c(=O)n(C)c(=O)c4n3ccc2=O)CC1
CN1CCN(CC2C[C@H]3[C@H](O2)c2ccccc2Sc2ccccc32)CC1
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1COc1ccccc21
CN(C)C[C@@H]1C[C@@H]2[C@@H](O1)c1ccccc1Cc1ccccc21
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1OCc1ccccc21
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21
CNCC1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21
OCCN1CCN(CC2C[C@H]3[C@H](O2)c2ccccc2Cc2ccccc32)CC1
CN(C)C[C@@H]1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21
CN(C)CC1C[C@@H]2[C@H](O1)c1ccccc1Oc1ccccc21
Clc1cccc(c1)N1CCN(CC2C[C@H]3[C@H](O2)c2ccccc2Cc2ccccc32)CC1
C(C1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21)N1CCOCC1
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1Sc1ccccc21
CN(C)CC1C[C@@H]2[C@H](O1)c1ccccc1Cc1ccccc21
CN1CCN(CC2C[C@H]3[C@H](O2)c2ccccc2Cc2ccccc32)CC1
C(C1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21)N1CCC(CC1)c1ccccc1
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1N(C)c1ccccc21
Fc1ccc(cc1)C(=O)C1CCN(CC2C[C@H]3[C@H](O2)c2ccccc2Cc2ccccc32)CC1
C(C1C[C@H]2[C@H](O1)c1ccccc1Sc1ccccc21)N1CCC(CC1)c1ccccc1
CN(C)CC1C[C@H]2[C@H](O1)c1ccccc1Oc1ccccc21
CN(C)C[C@H]1C[C@H]2[C@H](O1)c1ccccc1Cc1ccccc21
[#6]C1([#8])c2ccccc2-c2ccc(cc12)-[#6](=O)[#7]=[#6]([#7])-[#7]
CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
c1cc2c(cc1C#N)c(c[nH]2)CCCCN3CCN(CC3)c4ccc5c(c4)cc(o5)C(=O)N
OC1(CCN(CCCCc2ccc(F)cc2)CC1)c1ccc(Cl)cc1
OC1(CCN(CCCOc2ccc(F)cc2)CC1)c1ccc(Cl)cc1
OC1(CCN(CCCSc2ccc(F)cc2)CC1)c1ccc(Cl)cc1
OC1(CC2CCC(C1)N2CCCC(=O)c1ccc(F)cc1)c1ccc(Cl)cc1 |TLB:9:8:1.2.7:4.5,0:1:8:4.5|
OC1(CC2CCC(C1)N2CCCCc1ccc(F)cc1)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,20:1:8:4.5,0:1:8:4.5|
OC1(CC2CCC(C1)N2CCCOc1ccc(F)cc1)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,20:1:8:4.5,0:1:8:4.5|
OC1(CC2CCC(C1)N2CCCSc1ccc(F)cc1)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,20:1:8:4.5,0:1:8:4.5|
OC1(CC2CCC(C1)N2CCCSc1cccc(F)c1)c1ccc(Cl)cc1 |TLB:20:1:8:4.5,0:1:8:4.5,9:8:4.5:2.1.7|
OC1(CC2CCC(C1)N2CCCSc1ccccc1F)c1ccc(Cl)cc1 |TLB:20:1:8:4.5,0:1:8:4.5,9:8:4.5:2.1.7|
CO[C@H]([C@@H](C)N)c1cc(OC)c(Br)cc1OC
CO[C@@H]([C@H](C)N)c1cc(OC)c(Br)cc1OC
CCC(N)Cc1cc(OC)c(Br)cc1OC
COc1cc([C@H](O)[C@H](C)N)c(OC)cc1Br
COC(CN)c1cc(OC)c(Br)cc1OC
COc1cc([C@@H](O)[C@H](C)N)c(OC)cc1Br
CC[C@H](N)[C@H](O)c1cc(OC)c(Br)cc1OC
COc1cc(C(O)CN)c(OC)cc1Br
CO[C@@H]([C@@H](C)N)c1cc(OC)c(Br)cc1OC
COc1cc([C@@H](O)[C@@H](C)N)c(OC)cc1Br
COc1cc(C2CNCCO2)c(OC)cc1Br
CO[C@H]([C@H](C)N)c1cc(OC)c(Br)cc1OC
COc1cc([C@H](O)[C@@H](C)N)c(OC)cc1Br
CCN(C1CCN(CCC(c2ccccc2)c2ccccc2)CC1)C(=O)Cc1ccc(cc1)S(=O)(=O)N(C)C
COc1cccc(c1)N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
O=C(CCCCCN1CCN(CC1)c1cccc(c1)C#N)NC1CCCc2ccccc12
CC(=O)c1cccc(c1)N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
COc1ccc(OC)c(c1)N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
COc1cc(Cl)ccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
Clc1ccccc1S(=O)(=O)n1cc(C2=CCNCC2)c2ccccc12 |t:14|
COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1
COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1
C1CC1N1CCN(CC1)c1ccc2ccccc2n1
O=C(C1CC1)c1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
CCN1CCN(CC1)c1cc(-c2ccc(F)cc2)c2CC[C@@H](O)CCCc2n1
CCN1CCN(CC1)c1cc(-c2ccc(F)cc2)c2CCC[C@H](O)CCc2n1
CCN1CCN(CC1)c1cc(-c2ccc(F)cc2)c2CC[C@H](O)CCCc2n1
CCN1CCN(CC1)c1cc(-c2ccc(F)cc2)c2CCC[C@@H](O)CCc2n1
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1ccc2ccccc2c1
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1ccccc1
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1cccc2ccccc12
COc1ccc(Cl)cc1S(=O)(=O)n1cc(\C=N\N=C\N(C)C)c2c(cccc12)[N+]([O-])=O
COc1ccc(OC)c(c1)S(=O)(=O)n1cc(\C=N\N=C\N(C)C)c2c(cccc12)[N+]([O-])=O
COc1ccc(cc1)S(=O)(=O)n1cc(\C=N\N=C\N(C)C)c2c(cccc12)[N+]([O-])=O
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1ccc(C)cc1
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1ccc(I)cc1
CN(C)\C=N\N=C\c1cn(c2cccc([N+]([O-])=O)c12)S(=O)(=O)c1ccc(F)cc1
COc1ccc2CCNCC(C)c2c1
CC1CNCCc2c(Cl)cccc12
CC1CNCCc2ccccc12
COc1cc2CCNCCc2cc1Br
CC1CNCCc2cc(F)c(Cl)cc12
COc1cc2CCNC[C@H](C)c2cc1Br
CC1CNCCc2cc(O)c(Br)cc12
CC1CNCCc2cc(Cl)c(Cl)cc12
CC1CNCCc2cc(Cl)ccc12
CC1CNCCc2ccc(F)cc12
COc1cc2CCNCC(C)c2cc1C(F)(F)F
COc1cc2CCNCC(C)c2cc1Cl
C[C@H]1CNCCc2c1cc(cc2)Cl
Clc1ccc2CCNCCc2c1
CC1CNCCc2ccc(Cl)cc12
COc1cc2CCNC[C@@H](C)c2cc1Br
C[C@@H]1CNCCc2ccc(Cl)cc12
CC1CNCCc2cc(OCc3ccccc3)c(Br)cc12
CC1CNCCc2cccc(Cl)c12
C[C@H]1CNCCc2ccc(Cl)c(Cl)c12
CC1CNCCc2c(Cl)cc(Cl)cc12
C[C@@H]1CNCCc2ccc(Cl)c(Cl)c12
COc1ccc2C(C)CNCCc2c1
CC1CNCCc2ccc(Cl)c(F)c12
CCC1CNCCc2cc(OC)c(Br)cc12
CCOc1cc2CCNCC(C)c2cc1Br
COc1cc2CCNCC(C)c2cc1Br
CC1CNCCc2ccc(Cl)c(Cl)c12
COc1cc2CCNCC(C)c2cc1I
CC1CNCCc2ccc(cc12)C(F)(F)F
CC(C)Oc1cc2CCNCC(C)c2cc1Br
CC1CNCCc2ccc(Br)cc12
CN1CCN(CC1)C1=Cc2cc(Cl)ccc2Cn2cccc12 |t:8|
CN1CCN(CC1)C1=Cn2cccc2Sc2sccc12 |t:8|
CN1CCN(CC1)C1=Cc2ccccc2Cn2c(C)ccc12 |t:8|
CN1CCN(CC1)C1=Cn2cccc2Sc2ccccc12 |t:8|
CN1CCN(CC1)C1=Cc2ccccc2Cn2cccc12 |t:8|
CN(C)C[C@H]1CC2[C@H](O1)c1cc(F)ccc1Sc1ccccc21
CN(C)C[C@H]1CC2[C@H](O1)c1cc(F)ccc1Oc1ccccc21
CN(C)C[C@@H]1CC2[C@H](O1)c1cc(F)ccc1Oc1ccccc21
CN(C)C[C@H]1CC2[C@H](O1)c1cc(Cl)ccc1Oc1ccccc21
CN(C)C[C@H]1CC2[C@H](O1)c1ccccc1Cc1ccccc21
CN(C)C[C@H]1C[C@H]2[C@H](O1)c1cc(F)ccc1Sc1ccccc21
CN(C)C[C@@H]1CC2[C@H](O1)c1cc(Cl)ccc1Oc1ccccc21
CN(C)C[C@@H]1CC2[C@H](O1)c1cc(F)ccc1Sc1ccccc21
CN(C)C[C@H]1CC2[C@H](O1)c1cc(Br)ccc1Oc1ccccc21
CN(C)C[C@@H]1CC2[C@H](O1)c1cc(Br)ccc1Oc1ccccc21
CN(C)[C@@H]1C[C@@H](c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(F)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(F)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(Cl)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(Cl)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(Br)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(Br)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)C(F)(F)F)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)C(F)(F)F)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(F)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(F)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(Cl)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(Cl)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(Br)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(Br)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(cc2)C(F)(F)F)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(cc2)C(F)(F)F)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(cc2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2Br)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2Br)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](C2CCCCC2)c2ccccc2C1
CN(C)[C@H]1C[C@H](C2CCCCC2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](C2CCCCCCC2)c2ccccc2C1
CN(C)[C@H]1C[C@H](C2CCCCCCC2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2Cl)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2Cl)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2C)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2C)c2ccccc2C1
Fc1ccc2CC(CC3CNC=N3)Cc2c1 |c:11|
COc1cccc2[C@H](CN(C)CCc3ccc4ccoc4c3)CCCc12
CCS(=O)(=O)c1nc(c(s1)N1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1
Clc1ccc2NC(=O)C(c2c1)(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
Brc1ccc(s1)S(=O)(=O)Nc1ccn(Cc2cccc3ccccc23)n1
Oc1c(Sc2cccc3cccnc23)cc(NS(=O)(=O)c2ccc(F)cc2)c2ccccc12
Oc1c(Sc2cccc3cccnc23)cc(NS(=O)(=O)c2ccccc2)c2ccccc12
Cc1ccc(cc1)S(=O)(=O)c1nc(sc1Cl)N1CCc2ccccc2C1
O=S(=O)(Nc1cc2C3CCCCC3(Oc2c2ccccc12)N1CCOCC1)c1ccccc1
Fc1ccc(cc1)S(=O)(=O)N1CC=c2ccccc2=C1c1c[nH]c2ccccc12 |c:20,t:13|
Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1ccccc1)S(=O)(=O)c1ccccc1
O=S(=O)(N1C=Cc2ccccc2C1c1c[nH]c2ccccc12)c1ccccc1 |c:4|
Brc1ccc2n3CCN(Cc4ccccc4)C4CCCc(c34)c2c1
Cc1ccc(cc1)S(=O)(=O)N\N=C1/CCCc2c1[nH]c1ccc(Cl)cc21
Clc1ccc(cc1)S(=O)(=O)Nc1ccccc1-c1nccc2ccccc12
Fc1cc(Cl)ccc1CN1c2ccccc2S(=O)(=O)c2ccccc12
O=c1ccc(n[nH]1)-c1ccc(s1)S(=O)(=O)Nc1cccc2CCCCc12
COc1cccc(c1)-n1cc(C(=O)N(C)c2cccc(Cl)c2)c2ccccc2c1=O
Cc1ccc(Nc2c(cnc3ccc(Cl)cc23)S(=O)(=O)c2ccccc2)cc1
NC(=O)C1CCN(CC1)c1c(cnc2ccc(Cl)cc12)S(=O)(=O)c1ccccc1
Cc1ccc(cc1)S(=O)(=O)c1cnc2ccc(F)cc2c1SCc1ccc(Cl)cc1
COCCn1c(C)c(C)c(c1N)S(=O)(=O)c1ccc(Cl)cc1
CN(C(=O)c1cn(-c2ccc(F)cc2F)c(=O)c2ccccc12)c1cc(Cl)ccc1C
Cc1ccc2on(C[C@@H]3C[C@@H]4[C@H](O3)c3cc(Br)ccc3Oc3ccccc43)c2c1
Brc1ccc2Oc3ccccc3[C@@H]3C[C@@H](Cn4oc5ccc(cc45)C#N)O[C@@H]3c2c1
Brc1ccc2Oc3ccccc3[C@@H]3C[C@@H](Cn4oc5ccc(cc45)N4CCC4=O)O[C@@H]3c2c1
CN(C)c1ccc2on(C[C@@H]3C[C@@H]4[C@H](O3)c3cc(Br)ccc3Oc3ccccc43)c2c1
CCOC(=O)c1ccc2on(C[C@@H]3C[C@@H]4[C@H](O3)c3cc(Br)ccc3Oc3ccccc43)c2c1
COc1ccc2Oc3ccccc3[C@@H]3C[C@H](CN(C)C)O[C@@H]3c2c1
CN(C)C[C@@H]1C[C@@H]2[C@H](O1)c1cc(Br)ccc1Oc1ccccc21
CN(C)C[C@H]1C[C@@H]2[C@H](O1)c1cc(Br)ccc1Oc1ccccc21
Brc1ccc2Oc3ccccc3[C@@H]3C[C@@H](Cn4oc5ccc(cc45)-c4ccccc4)O[C@@H]3c2c1
CN(C)C[C@H]1C[C@@H]2[C@H](O1)c1cc(F)ccc1Oc1ccccc21
Brc1ccc2Oc3ccccc3[C@@H]3C[C@@H](Cn4oc5ccc(CN6CCOCC6)cc45)O[C@@H]3c2c1
CN(C)C[C@@H]1C[C@@H]2[C@H](O1)c1cc(F)ccc1Oc1ccccc21
CN(C)C[C@H]1C[C@@H]2[C@H](O1)c1cc(Cl)ccc1Oc1ccccc21
Brc1ccc2Oc3ccccc3[C@@H]3C[C@@H](Cn4oc5ccc(cc45)N4CCOCC4)O[C@@H]3c2c1
CN(C)C[C@@H]1C[C@@H]2[C@H](O1)c1cc(Cl)ccc1Oc1ccccc21
Nc1ccc2on(C[C@@H]3C[C@@H]4[C@H](O3)c3cc(Br)ccc3Oc3ccccc43)c2c1
COc1ccc2Oc3ccccc3[C@@H]3C[C@@H](CN(C)C)O[C@@H]3c2c1
CN(C)C[C@H]1C[C@@H]2[C@@H](O1)c1ccccc1Oc1ccccc21
Fc1cccc(CCCNCCc2ccnc(n2)-n2ccnc2)c1
CSc1ccccc1N1CCN(CCCCCC(=O)N2Cc3ccccc3C[C@H]2C(N)=O)CC1 |r|
NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCCCN1CCN(CC1)c1ccccc1-c1ccccc1 |r|
CC(C)c1ccccc1N1CCN(CCCCCCC(=O)N2CCC[C@H]2C(=O)N2CCCCC2)CC1 |r|
O=C(CCCCN1CCN(CC1)c1ccccc1-c1ccccc1)N1CCC[C@H]1C(=O)N1CCCCC1 |r|
NC(=O)c1ccccc1OCCCN1CCN(CC1)c1cccc2n(ccc12)S(=O)(=O)c1ccccc1
C[C@@H]1CNC[C@H]2Cc3ccc(C)c(C)c3N12
C[C@@H]1CNC[C@@H]2Cc3ccc(Cl)c(C)c3N12
Cc1c2N3CCNC[C@@H]3Cc2ccc1Cl
C[C@@H]1CNC[C@H]2Cc3ccc(C)cc3N12
Clc1ccc2CC3CNCCN3c2c1
C[C@@H]1CNC[C@H]2Cc3cccc(C)c3N12
Cc1c2N3CCNC[C@H]3Cc2ccc1Cl
C[C@@H]1CNC[C@H]2Cc3ccc(Cl)c(C)c3N12
C[C@@H]1CNC[C@@H]2Cc3ccc(C)c(C)c3N12
C[C@@H]1CNC[C@H]2Cc3ccc(cc3N12)C(F)(F)F
C[C@@H]1CNC[C@H]2Cc3ccc(NC(C)=O)cc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(cc3N12)C#N
C[C@@H]1CNC[C@H]2Cc3ccc(CO)cc3N12
Fc1ccc(cc1)S(=O)(=O)C1(F)CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCC(CC2)S(=O)(=O)c2ccccc2)c(F)c1
Fc1ccc(cc1)S(=O)(=O)C1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccc(cc2)-n2cccn2)c(F)c1
Fc1ccc(C(=O)CN2CCC(CC2)S(=O)(=O)c2ccccc2)c(F)c1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccc(cc2)C#N)c(F)c1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccccc2)c(F)c1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccc(cc2)-n2ccnn2)c(F)c1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccc(cc2)N2CCC2)c(F)c1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccc(Cl)cc2)c(F)c1
Fc1cccc(c1)S(=O)(=O)C1(F)CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCC(F)(CC2)S(=O)(=O)c2ccccc2F)c(F)c1
CCOc1nc(NC(=O)C(C)(C)NC(=O)c2ccc3c(C4CCCC4)c(-c4ccc(F)cn4)n(C)c3c2)ccc1\C=C\C(O)=O
CCOc1nc(NC(=O)C(C)(C)NC(=O)c2ccc3c(C4CCCC4)c(-c4ncc(Cl)cn4)n(C)c3c2)cnc1\C=C\C(O)=O
Cc1[nH]c2ccc(Cl)cc2c1C1=CCNCC1 |t:13|
COc1ccc2[nH]c(C)c(C3=CCNCC3)c2c1 |t:10|
CN1CCN(CCc2c[nH]c3cccc(O)c23)CC1
CCCCn1cc(CCN(C)C)c2c(O)cccc12
CN(C)CCc1c[nH]c2cc(O)ccc12
Oc1cccc2[nH]cc(CCN3CCCc4ccccc34)c12
CN(C)CCc1cn(C)c2cccc(O)c12
CCCCn1cc(CCN(C)C)c2c(OP(O)(O)=O)cccc12
CC(Cc1c[nH]c2cccc(O)c12)N(C)C
CN(C)CCc1cn(C)c2cccc(OP(O)(O)=O)c12
CN(C)Cc1c[nH]c2cccc(O)c12
CN(C)CCn1ccc2c(O)cccc12
CN(C)CCc1c(C)[nH]c2cccc(O)c12
CN(C)CCCc1c[nH]c2cccc(O)c12
Oc1cccc2[nH]cc(CCN3CCCC3)c12
CN(C)Cc1cn(C)c2cccc(O)c12
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cc(F)cc12
O=C1CC(c2ccccc2)c2cccc(CCN3CCN(CC3)c3nsc4ccccc34)c2N1
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3nsc4ccccc34)cc(F)cc12
CC1Cc2cccc(CCN3CCN(CC3)c3nsc4ccccc34)c2NC1=O
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3nsc4ccccc34)ccc(C)c12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3nsc4ccccc34)cc(Cl)cc12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3noc4ccccc34)cc(F)cc12
CC1CCN(C(=O)c2ccccc2)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
O=C1CCc2cccc(CCN3CCN(CC3)c3nsc4ccccc34)c2N1
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3ns(=O)c4ccccc34)cc(F)cc12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3noc4ccccc34)cc(C)cc12
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3noc4ccccc34)ccc(C)c12
COc1cccc(OC)c1CC(=O)N1CCC(C)c2cccc(CCN3CCN(CC3)c3nsc4ccccc34)c12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3noc4ccccc34)cccc12
CC(=O)N1CCC(c2ccccc2)c2cccc(CCN3CCN(CC3)c3nsc4ccccc34)c12
CC1CCN(C(=O)C2CCCCC2)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
CC1CC(=O)N(C)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
CC1(C)CCNc2c(CCN3CCN(CC3)c3nsc4ccccc34)cc(F)cc12
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3noc4ccccc34)cc(F)cc12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3nsc4ccccc34)ccc(C)c12
CC1CCN(C(C)=O)c2c(CCN3CCN(CC3)c3nsc4ccccc34)cc(Cl)cc12
CC1CC(=O)Nc2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
CC1(C)CCNc2c(CCN3CCN(CC3)c3nsc4ccccc34)cccc12
COc1cccc(CC(=O)N2CCC(C)c3cccc(CCN4CCN(CC4)c4nsc5ccccc45)c23)c1
O=C1C2C3CC(C=C3)C2C(=O)N1OCCCN1CCN(CC1)c1ncccn1 |c:6|
Clc1ccccc1N1CCN(CCCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:23|
FC(F)(F)c1cccc(c1)N1CCN(CCCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:26|
COc1ccccc1N1CCN(CCCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:24|
O=C1C2C3CC(C=C3)C2C(=O)N1OCCN1CCN(CC1)c1ncccn1 |c:6|
Clc1ccccc1N1CCN(CCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:22|
O=C1C2C3CC(C=C3)C2C(=O)N1OCCN1CCN(CC1)c1ccccn1 |c:6|
O=C1C2C3CC(C=C3)C2C(=O)N1OCCCN1CCN(CC1)c1ccccn1 |c:6|
COc1ccccc1N1CCN(CCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:23|
Clc1cccc(c1)N1CCN(CCCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:23|
Clc1cccc(c1)N1CCN(CCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:22|
FC(F)(F)c1cccc(c1)N1CCN(CCON2C(=O)C3C4CC(C=C4)C3C2=O)CC1 |c:25|
CN(C)CCOc1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3Cl)ccc2n1
CN(C)CCN(C)c1cc(C)c2cc(NC(=O)\C=C\c3ccc(OC(F)(F)F)cc3)ccc2n1
CCOc1ccc(Cl)cc1[C@H]1C[C@@H]1CN
CC(C)Oc1ccc(Cl)cc1[C@H]1C[C@@H]1CN
NC[C@H]1C[C@@H]1c1cc(Cl)ccc1OCC#C
CC(=C)COc1ccc(Cl)cc1[C@H]1C[C@@H]1CN
NC[C@H]1C[C@@H]1c1cc(Cl)ccc1OCCF
NC[C@@H]1C[C@H]1c1cc(Cl)ccc1OCC(F)F
NC[C@H]1C[C@@H]1c1cc(Cl)ccc1OCC(F)F
CCCOc1ccc(F)cc1[C@H]1C[C@@H]1CN
NC[C@@H]1C[C@H]1c1cc(F)ccc1OCC=C
NC[C@H]1C[C@@H]1c1cc(F)ccc1OCC=C
NC[C@H]1C[C@@H]1c1cc(F)ccc1OCC(F)=C
NC[C@@H]1C[C@H]1c1cc(F)ccc1OCCF
NC[C@H]1C[C@@H]1c1cc(F)ccc1OCCF
COc1ccccc1N1CCN(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccccc2)cc1N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2Cl)cc1N1CCN(C)CC1
COc1ccccc1N1CCC(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccc(F)cc2)cc1N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccc(Cl)cc2)cc1N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2F)cc1N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1N1CCN(C)CC1
COc1ccc(NC(=O)N2CCN(CC2)c2ccc(SC)cc2)cc1N1CCN(C)CC1
CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccnc4ccccc34)c(=O)c21
CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cncc4ccccc34)c(=O)c21
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCc1ccc2OCOc2c1
C[C@H](N)Cn1ccc2cc(Cl)c3ncccc3c12
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCC=C
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCc1ccccc1C
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCc1ccc2ccccc2c1
C[C@H](N)Cn1ccc2ccc3cnccc3c12
C[C@H](N)Cn1ccc2ccc3cccnc3c12
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCC1CCCCC1
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCc1ccccc1
C[C@H](N)Cn1ccc2ccc3ccncc3c12
C[C@@H](Cn1ccc2ccc3ncccc3c12)NCc1ccccc1Cl
COc1ccccc1CN[C@@H](C)Cn1ccc2ccc3ncccc3c12
C[C@H](N)Cn1ccc2ccc3ncccc3c12
Clc1ccc2CC3CNCCN3c2n1
C[C@@H]1CNC[C@@H]2Cc3ccc(Br)nc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(Br)nc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(Cl)nc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(CO)nc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(nc3N12)C#N
COCc1ccc2C[C@@H]3CNC[C@@H](C)N3c2n1
COc1ccc2C[C@@H]3CNC[C@@H](C)N3c2n1
C[C@@H]1CNC[C@H]2Cc3ccc(COCC4CC4)nc3N12
C[C@H](O)c1ccc2C[C@@H]3CNC[C@@H](C)N3c2n1
C[C@@H]1CNC[C@H]2Cc3ccc(nc3N12)C(F)(F)F
CCO[C@@H](C)c1ccc2C[C@@H]3CNC[C@@H](C)N3c2n1
C[C@@H]1CNC[C@@H]2Cc3ccc(Cl)nc3N12
C[C@@H]1CNC[C@H]2Cc3ccc(C)nc3N12
CCO[C@H](C)c1ccc2C[C@@H]3CNC[C@@H](C)N3c2n1
COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1
COc1cccc(c1)N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1
[H][C@]12CCCN(CCC)[C@]1([H])Cc1c[nH]nc1C2
CCCN(CCCCNC(=O)c1ccc(cc1)-c1ccccc1)[C@@H]1CCC(=CC1)C#C |r,c:28|
CCCN(CCCCNC(=O)c1ccc(cc1)-c1ccccc1)[C@H]1CCC(=CC1)C#C |r,c:28|
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN(CCC)[C@H]2COC(=CC2)C#C)nn1 |r,c:34|
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN(CCC)[C@@H]2COC(=CC2)C#C)nn1 |r,c:34|
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN(CCC)CCc2ccc(O)c3[nH]c(=O)ccc23)nn1
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN(CCC)[C@@H]2CCc3c(O)cccc3C2)nn1 |r|
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN(CCC)[C@H]2CCc3c(O)cccc3C2)nn1 |r|
C[C@@H]1C[C@H]2CNC[C@H]2N1c1nccc(n1)C(F)(F)F
FC(F)(F)c1ccnc(n1)N1CCC2CNCC12
FC(F)(F)c1cccc(c1)[C@H]1CC[C@H]2CNC[C@@H]12
Fc1cccc(c1)N1CC[C@H]2CNC[C@@H]12
FC(F)(F)c1ccnc(n1)N1CC[C@H]2CNC[C@@H]12
Clc1cccc(c1)N1CC[C@H]2CNC[C@@H]12
FC(F)(F)c1cccc(c1)N1CC[C@H]2CNC[C@@H]12
C[C@H]1C[C@H]2CNC[C@H]2N1c1nccc(n1)C(F)(F)F
Fc1cccc(c1)S(=O)(=O)N1CCC(CCc2ccc(F)cc2F)CC1
Fc1ccc(cc1)S(=O)(=O)N1CCC(CCc2ccc(F)cc2F)CC1
OC1(CCc2ccc(F)cc2F)CCN(CC1)S(=O)(=O)c1ccc(F)cc1
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2ccccc2Cl)c(F)c1
Fc1ccc(cc1)S(=O)(=O)N1CCC(CCc2ccc(F)cc2F)=CC1 |c:25|
Fc1ccc(cc1)S(=O)(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2ccccc2F)c(F)c1
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2ccccc2-c2cccc3cccnc23)c(F)c1
Fc1ccc(CCC2CCN(CC2)C(=O)c2ccccc2F)c(F)c1
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2ccccc2C#N)c(F)c1
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2ccccc2-c2cccc3ccccc23)c(F)c1
Fc1ccc(CCC2CCN(CC2)C(=O)c2cccc3cccnc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccc3c(c[nH]c23)C#N)c(F)c1
Fc1ccc(cc1)S(=O)(=O)N1CCC(F)(CCc2ccc(F)cc2F)CC1
[H][C@@]12Cc3cc(OCc4ccc(Br)cc4)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCc4ccccc4)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCC=C)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC4CCCCC4)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCC4CC4)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC(C)CCCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC(C)CCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC(C)CC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC(C)C)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCCF)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCCCCCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCCCCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCCCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OCC)c(OC)cc3-c3c(OC)c(OC)cc(CCN1C)c23 |r|
COc1cc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(-c2cc1OC)c34 |r|
COc1ccccc1N1CCN(CCCCNS(=O)(=O)c2ccc(C)cc2)CC1
CC(=O)Nc1cccc(c1)N1CCN(CCCCNS(=O)(=O)CC2CCCCC2)CC1
COc1nc(NCCCN2CCOCC2)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2cccc3ccccc23)c2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2c(N)cccc2Cl)c2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2ccccc2Cl)c2ccccc12 |t:8|
COc1cccc(OC)c1C(=O)NN1c2ccc(Cl)cc2N=C(N2CCN(C)CC2)c2ccccc12 |t:23|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2c(C)cccc2N)c2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2c(F)cccc2C(F)(F)F)c2ccccc12 |t:8|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2c(C)cccc2C)c2ccccc12 |t:8|
COc1cc2C(CN)CCc2c(OC)c1OC
COc1cc2[C@@H](CN)CCc2c(OC)c1OC
COc1cc2[C@H](CN)CCc2c(OC)c1OC
Clc1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCCCC3c3ccccc3)C2=O)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)NC3(CCCCC3c3ccccc3)C2=O)CC1
O=C1NC2(CCCCC2c2ccccc2)C(=O)N1CCCCN1CCN(CC1)c1ccccc1
FC(F)(F)c1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCC(CC3)c3ccccc3)C2=O)CC1 |(13.77,-9.92,;12.77,-9.21,;12.88,-7.98,;13.89,-8.69,;11.37,-9.85,;11.23,-11.39,;9.83,-12.03,;8.57,-11.14,;8.71,-9.61,;10.11,-8.96,;7.46,-8.72,;6.06,-9.36,;4.8,-8.47,;4.94,-6.94,;3.69,-6.04,;3.84,-4.51,;2.58,-3.61,;2.73,-2.08,;1.47,-1.19,;.02,-1.68,;-.35,-2.86,;-.88,-.44,;.02,.8,;1.44,1.44,;1.61,2.97,;.33,3.9,;-1.05,3.27,;-1.21,1.7,;.48,5.44,;-.76,6.34,;-.6,7.88,;.81,8.5,;2.05,7.59,;1.89,6.06,;1.47,.33,;2.47,1.05,;6.34,-6.29,;7.6,-7.18,)|
Clc1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCC(CC3)c3ccccc3)C2=O)CC1 |(12.49,-9.34,;11.37,-9.85,;11.23,-11.39,;9.83,-12.03,;8.57,-11.14,;8.71,-9.61,;10.11,-8.96,;7.46,-8.72,;6.06,-9.36,;4.8,-8.47,;4.94,-6.94,;3.69,-6.04,;3.84,-4.51,;2.58,-3.61,;2.73,-2.08,;1.47,-1.19,;.02,-1.68,;-.35,-2.86,;-.88,-.44,;.02,.8,;1.44,1.44,;1.61,2.97,;.33,3.9,;-1.05,3.27,;-1.21,1.7,;.48,5.44,;-.76,6.34,;-.6,7.88,;.81,8.5,;2.05,7.59,;1.89,6.06,;1.47,.33,;2.47,1.05,;6.34,-6.29,;7.6,-7.18,)|
COc1ccccc1N1CCN(CCCCN2C(=O)NC3(CCC(CC3)c3ccccc3)C2=O)CC1 |(7.06,-13.02,;7.17,-11.79,;8.57,-11.14,;9.83,-12.03,;11.23,-11.39,;11.37,-9.85,;10.11,-8.96,;8.71,-9.61,;7.46,-8.72,;6.06,-9.36,;4.8,-8.47,;4.94,-6.94,;3.69,-6.04,;3.84,-4.51,;2.58,-3.61,;2.73,-2.08,;1.47,-1.19,;.02,-1.68,;-.35,-2.86,;-.88,-.44,;.02,.8,;1.44,1.44,;1.61,2.97,;.33,3.9,;-1.05,3.27,;-1.21,1.7,;.48,5.44,;-.76,6.34,;-.6,7.88,;.81,8.5,;2.05,7.59,;1.89,6.06,;1.47,.33,;2.47,1.05,;6.34,-6.29,;7.6,-7.18,)|
O=C1NC2(CCC(CC2)c2ccccc2)C(=O)N1CCCCN1CCN(CC1)c1ccccc1 |(-.35,-2.86,;.02,-1.68,;-.88,-.44,;.02,.8,;1.44,1.44,;1.61,2.97,;.33,3.9,;-1.05,3.27,;-1.21,1.7,;.48,5.44,;-.76,6.34,;-.6,7.88,;.81,8.5,;2.05,7.59,;1.89,6.06,;1.47,.33,;2.47,1.05,;1.47,-1.19,;2.73,-2.08,;2.58,-3.61,;3.84,-4.51,;3.69,-6.04,;4.94,-6.94,;4.8,-8.47,;6.06,-9.36,;7.46,-8.72,;7.6,-7.18,;6.34,-6.29,;8.71,-9.61,;8.57,-11.14,;9.83,-12.03,;11.23,-11.39,;11.37,-9.85,;10.11,-8.96,)|
FC(F)(F)c1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCCc4ccccc34)C2=O)CC1
Clc1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCCc4ccccc34)C2=O)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)NC3(CCCc4ccccc34)C2=O)CC1
O=C1NC2(CCCc3ccccc23)C(=O)N1CCCCN1CCN(CC1)c1ccccc1
FC(F)(F)c1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCc4ccccc34)C2=O)CC1
Clc1cccc(c1)N1CCN(CCCCN2C(=O)NC3(CCc4ccccc34)C2=O)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)NC3(CCc4ccccc34)C2=O)CC1
O=C1NC2(CCc3ccccc23)C(=O)N1CCCCN1CCN(CC1)c1ccccc1
COc1cc(Br)c(OC)c2C[C@@H](CN)c12
COc1cc(Br)c2OC[C@H]3CCC[C@@H](CN)c1c23
COc1cc(Br)c2OC[C@H]3CCC[C@H](CN)c1c23
COc1cc(Br)c(OC)c2C[C@H](CN)c12
COc1cc(Br)c(OC)c2CCC(CN)c12
COc1cc(Br)c(OC)c2CC(CN)c12
Cc1ccc(cc1)C1=NCCN=C(C1)NC(C)(C)Cc1ccccc1 |c:12,t:8|
CCC1(CCCC1)N=C1CC(=NCCN1)c1ccc(F)cc1F |w:7.7,c:11|
CCC(C)(CC)NC1=NCCN=C(C1)c1ccccc1F |c:11,t:7|
Cc1ccc(c(C)c1)C1=NCCN=C(C1)NC(C)(C)C |c:13,t:9|
CCC(C)(CC)NC1=NCCN=C(C1)c1ccc(F)cc1 |c:11,t:7|
Cc1ccc(cc1)C1=NCCN=C(C1)NC(C)(C)C |c:12,t:8|
CC(C)(C)NC1=NCCN=C(C1)c1ccc(cc1)C#N |c:9,t:5|
CC(C)(N=C1CC(=NCCN1)c1ccc(F)cc1F)C1CCC1 |w:3.2,c:6|
CCN(CC)C1=NCCN=C(C1)c1ccc(C)cc1 |c:9,t:5|
Cc1ccc(c(F)c1)C1=NCCN=C(C1)NC(C)(C)C |c:13,t:9|
CC(C)(C)CNC1=NCCN=C(C1)c1ccccc1F |c:10,t:6|
CCN(CC)C1=NCCN=C(C1)c1ccccc1F |c:9,t:5|
CCC1(CCCC1)NC1=NCCN=C(C1)c1ccccc1F |c:13,t:9|
CC(C)(C)NC1=NCCN=C(C1)c1ccccc1Cl |c:9,t:5|
CC(C)(C)NC1=NCCN=C(C1)c1ccccc1 |c:9,t:5|
Cc1ccccc1C1=NCCN=C(C1)NC(C)(C)C |c:12,t:8|
CCC1(CCCC1)N=C1CC(=NCCN1)c1ccc(F)cc1 |w:7.7,c:11|
CC(C)(C)NC1=NCCN=C(C1)c1cccc(c1)C(F)(F)F |c:9,t:5|
COc1ccc(cc1)C1=NCCN=C(C1)NC(C)(C)C |c:13,t:9|
CCC(CC)(CC)NC1=NCCN=C(C1)c1ccc(F)cc1F |c:12,t:8|
Cc1ccc(cc1)C1=NCCN=C(C1)N1CCOCC1 |c:12,t:8|
CC(C)(C)NC1=NCCN=C(C1)c1ccc(F)cc1F |c:9,t:5|
CC(C)(C)NC1=NCCN=C(C1)c1ccccc1F |c:9,t:5|
CCC(C)(CC)NC1=NCCN=C(C1)c1ccc(C)cc1 |c:11,t:7|
CC(C)(Cc1ccccc1)NC1=NCCN=C(C1)c1ccccc1F |c:16,t:12|
CC(C)(C)NC1=NCCN=C(C1)c1ccc(F)cc1 |c:9,t:5|
CC1(CCCCC1)NC1=NCCN=C(C1)c1ccc(F)cc1 |c:13,t:9|
Cc1ccc(cc1)C1=NCCN=C(C1)N1CCNCC1 |c:12,t:8|
COc1ccccc1N1CCN(CCCCNC(=O)\N=N\c2ccc(F)cc2)CC1
CCCN(CCCCNC(=O)\C=C\c1ccc(F)cc1)C1Cc2ccccc2C1
CCCN(CCCCNC(=O)\N=N\c1ccc(F)cc1)C1Cc2ccccc2C1
CCCN(CCNC(=O)\C=C\c1ccc(F)cc1)C1Cc2ccccc2C1
CCCN(CCNC(=O)\N=N\c1cc(F)c(F)c(F)c1)C1Cc2ccccc2C1
COc1cc(CCNCc2cccc3OCOc23)c(OC)cc1Br
COc1cc(CCNCc2cccc3CCOc23)c(OC)cc1Br
COc1cccc(OC)c1CNCCc1cc(OC)c(Br)cc1OC
COc1cccc(CNCCc2cc(OC)c(Br)cc2OC)c1F
COc1cccc(CNCCc2cc(OC)c(Br)cc2OC)c1O
COc1cc(CCNCc2cccc3ncoc23)c(OC)cc1Br
COc1cc(CCNCc2cccc3ccsc23)c(OC)cc1Br
COc1cc(CCNCc2cccc3ccoc23)c(OC)cc1Br
COc1cc(CCNCc2cccc(O)c2)c(OC)cc1Br
COc1cccc(CNCCc2cc(OC)c(Br)cc2OC)c1
COc1ccc(OC)c(CNCCc2cc(OC)c(Br)cc2OC)c1
COc1ccc(CNCCc2cc(OC)c(Br)cc2OC)c(OC)c1
COc1cccc(CNCCc2cc(OC)c(Br)cc2OC)c1OC
COc1cc(CCNCc2ccncc2)c(OC)cc1Br
COc1cc(CCNCc2cccnc2)c(OC)cc1Br
COc1cc(CCNCc2ccccn2)c(OC)cc1Br
COc1cc(CCNCc2cccnc2OC)c(OC)cc1Br
COc1cc(CCNCc2ccc[nH]c2=O)c(OC)cc1Br
COc1cc(CCNCc2cccc3cc[nH]c23)c(OC)cc1Br
COc1cc(CCNCc2cccc3cn[nH]c23)c(OC)cc1Br
COc1cc(CCNCc2cccc3nc[nH]c23)c(OC)cc1Br
NC(N)=NCCC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3cc(Br)ccc23)NC1=O |r,wU:7.6,11.11,(32.28,3.26,;30.95,4.04,;30.96,5.58,;29.62,3.28,;28.29,4.05,;26.95,3.29,;25.62,4.07,;24.28,3.3,;22.95,4.08,;21.61,3.31,;20.27,4.08,;21.62,1.78,;20.28,1.01,;20.28,-.53,;21.53,-1.44,;21.05,-2.91,;19.51,-2.9,;18.47,-4.05,;16.96,-3.72,;15.92,-4.86,;16.5,-2.25,;17.53,-1.11,;19.03,-1.44,;22.94,1,;24.27,1.76,;25.6,.98,)|
NC(N)=NCCC[C@@H]1NC(=O)C(NC1=O)=Cc1c[nH]c2cc(Br)ccc12 |r,w:15.16,wU:7.6,(9.1,2.09,;7.77,2.87,;7.78,4.41,;6.44,2.1,;5.11,2.88,;3.77,2.11,;2.44,2.89,;1.1,2.13,;-.23,2.9,;-1.57,2.14,;-2.91,2.91,;-1.56,.6,;-.24,-.18,;1.09,.59,;2.42,-.19,;-2.89,-.17,;-2.9,-1.71,;-1.65,-2.61,;-2.13,-4.08,;-3.67,-4.08,;-4.71,-5.23,;-6.22,-4.9,;-7.26,-6.03,;-6.68,-3.42,;-5.65,-2.29,;-4.14,-2.61,)|
CN1CCc2cc(N)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(O)c(N)cc2C(C1)c1ccccc1
CN1CCc2cc(NCc3ccccc3)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(NCc3cccc(Cl)c3)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(NCc3cccc(C)c3)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(NCc3ccccc3C)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(NCc3ccc(C)cc3)c(O)cc2C(C1)c1ccccc1
CN1CCc2cc(c(O)cc2C(C1)c1ccccc1)-c1cccc(C)c1
CN1CCc2cc(c(O)cc2C(C1)c1ccccc1)-c1ccc(O)cc1
CN1CCc2ccc(O)cc2C(C1)c1ccccc1
CC(=O)Nc1ccc(SCCCN2CCN(CC2)c2ccccc2C)cc1
CC(=O)Nc1ccc(SCCCN2CCN(CC2)c2cccc(C)c2)cc1
Cc1cccc(c1)N1CCN(CCCSc2ccccc2)CC1
Cc1cccc(c1)N1CCN(CCCSc2ccc(cc2)[N+]([O-])=O)CC1
O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc2ccccc2c1
Brc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Cc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Cc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2ccccc2c1
Clc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Fc1c(F)c(F)c(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c(F)c1F
O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc2ccccc2c1
Brc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
O=C(NC1CCN(Cc2ccncc2)CC1)c1ccc2ccccc2c1
Cc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
COc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Clc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Brc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
O=C(NC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1
COc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
[O-][N+](=O)c1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Clc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2ccccc2c1
O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc2ccccc12
O=C(NC1CCN(CCCCc2ccccc2)CC1)c1ccc2ccccc2c1
CC(N1CCC(CC1)NC(=O)c1ccc2ccccc2c1)c1ccccc1 |w:1.0|
O=C(NC1CCN(CCCc2ccccc2)CC1)c1ccc2ccccc2c1
O=C(NC1CCN(CCc2ccccc2)CC1)c1ccc2ccccc2c1
CC(N1CCC(CC1)NC(=O)c1cccc2ccccc12)c1ccccc1 |w:1.0|
O=C(N1CCC(CC1)NCCc1ccccc1)c1cccc2ccccc12
O=C(NC1CCN(CCc2ccccc2)CC1)c1cccc2ccccc12
O=C(NC1CCN(CCCCc2ccccc2)CC1)c1cccc2ccccc12
CC[C@@](O)(N1CCC(CC1)NC(=O)c1cccc2ccccc12)c1ccccc1
O=C(NC1CCN(CCCc2ccccc2)CC1)c1cccc2ccccc12
CCc1cc2[C@@H]3CNCCN3C(=O)c2cc1OC
FC(F)(F)c1ccc(Cl)c2[C@@H]3CNCCN3C(=O)c12
FC(F)(F)c1cccc2[C@@H]3CNCCN3C(=O)c12
FC(F)(F)c1cc(C=C)cc2[C@@H]3CNCCN3C(=O)c12
CC(=O)c1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
CSc1cccc2C3CNCCN3C(=O)c12
Fc1cccc2C3CNCCN3C(=O)c12
CCOc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
CCc1ccc2[C@@H]3CNCCN3C(=O)c2c1OC
C[C@H]1CNC[C@@H]2N1C(=O)c1c2cccc1C(F)(F)F
O=C1N2CCNCC2c2ccccc12
COc1cc2[C@@H]3CNCCN3C(=O)c2c(Cl)c1
FC(F)(F)c1cccc2C3CNCCN3C(=O)c12
CC1(CC1)c1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
FC(F)(F)c1cc(Cl)cc2[C@@H]3CNCCN3C(=O)c12
COc1c2C(=O)N3CCNC[C@H]3c2ccc1Cl
C[C@@H]1CN2[C@@H](CN1)c1cccc(c1C2=O)C(F)(F)F
Cc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
CC(C)Oc1cccc2C3CNCCN3C(=O)c12
C[C@@H]1NCCN2[C@@H]1c1cccc(c1C2=O)C(F)(F)F
FC(F)(F)c1cc(cc2[C@@H]3CNCCN3C(=O)c12)C#C
CCCc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
COc1cc2C(=O)N3CCNC[C@H]3c2cc1Cl
CC(C)c1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
Cc1ccc(Cl)c2C(=O)N3CCNC[C@H]3c12
CCc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
FC(F)(F)c1cccc2[C@H]3CNCCN3C(=O)c12
C[C@@H]1CNC[C@@H]2N1C(=O)c1c2cccc1C(F)(F)F
CC1(C)CN2[C@@H](CN1)c1cccc(c1C2=O)C(F)(F)F
CN1CCN2[C@@H](C1)c1cccc(c1C2=O)C(F)(F)F
COc1ccc(Cl)c2[C@@H]3CNCCN3C(=O)c12
C[C@H]1CN2[C@@H](CN1)c1cccc(c1C2=O)C(F)(F)F
CCc1ccc(Cl)c2C(=O)N3CCNC[C@H]3c12
Oc1cccc2C3CNCCN3C(=O)c12
FC(F)(F)Oc1cccc2C3CNCCN3C(=O)c12
Clc1cccc2C3CNCCN3C(=O)c12
CCCCc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
O=C1N2CCNCC2c2cccc(C#N)c12
COc1cccc2C3CNCCN3C(=O)c12
Clc1ccc2[C@@H]3CNCCN3C(=O)c2c1Cl
CCc1cc2[C@@H]3CNCCN3C(=O)c2c(Cl)c1
COc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
FC(F)(F)c1cc(cc2[C@@H]3CNCCN3C(=O)c12)C1CC1
CC[C@@H]1NCCN2[C@@H]1c1cccc(c1C2=O)C(F)(F)F
OCc1cc2[C@@H]3CNCCN3C(=O)c2c(c1)C(F)(F)F
COc1ccc(Cl)c2C(=O)N3CCNC[C@H]3c12
Clc1cccc(c1)N1CCN(CCCC[C@@H]2CCCN2C(=O)C2CCCCC2)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C3CCCCC3)C2=O)CC1 |r|
COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1 |r,TLB:22:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,32:24:27:31.30.29,32:30:27:33.25.24|
COc1ccccc1N1CCN(CCCC[C@@H]2CCCN2C(=O)CC2CC3CCC2C3)CC1 |w:24.25,29.30,26.28,TEB:23:24:27.28:30|
Clc1cccc(c1)N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C3CCCCC3)C2=O)CC1 |r|
Clc1cccc(c1)N1CCN(CCCCN2C(=O)CCC2=O)CC1
Clc1cccc(c1)N1CCN(CCCC[C@@H]2CCCN2C(=O)CC2CC3CCC2C3)CC1 |w:23.24,28.29,25.27,TEB:22:23:26.27:29|
Clc1cccc(c1)N1CCN(CCCC[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C3CCCC3)C2=O)CC1
Clc1cccc(c1)N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1
COc1ccccc1N1CCN(CCCC[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1
Clc1cccc(c1)N1CCN(CCCCN2C(=O)C[C@H](NC(=O)C3CCCC3)C2=O)CC1
COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(=O)CC3CC4CCC3C4)C2=O)CC1 |r,THB:24:25:28.29:31|
COc1ccccc1N1CCN(CCCCN2C(=O)CCC2=O)CC1
Clc1cccc(c1)N1CCN(CCCCN2C(=O)C[C@H](NC(=O)CC3CC4CCC3C4)C2=O)CC1 |w:24.24,29.29,26.27,TEB:23:24:27.28:30|
COc1ccccc1N1CCN(CCCC[C@@H]2CCCN2C(=O)C2CCCCC2)CC1
COC(=O)C1(CC1CN1CCC(O)(CC1)c1ccccc1)c1ccc(C)cc1
OC(CCNC(=O)c1cc2ccccc2[nH]1)CN1CCN(CC1)c1cccc(Cl)c1Cl
O=C(NCCCCN1CCN(CC1)c1cccc2ccccc12)c1cc2ccccc2[nH]1
Fc1ccc2[nH]c(cc2c1)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CC(O)CCNC(=O)c2cnc3ccccc3c2)CC1
O=C(NCCCCN1CCN(CC1)c1cccc2ccccc12)c1cnc2ccccc2c1
OC(CCNC(=O)c1cnc2ccccc2c1)CN1CCN(CC1)c1cccc2ccccc12
COc1c(Cl)cccc1N1CCN(CCCCNC(=O)c2cnc3ccccc3c2)CC1
CC(=O)N1CC[C@@H](CN2CCC[C@@H](Cc3ccc(F)cc3)C2)[C@@H](C1)NC(=O)Nc1nc(C)c(s1)C(C)=O
CC(=O)c1cccc(NC(=O)N[C@@H]2CCCC[C@H]2CN2CCC[C@@H](Cc3ccc(F)cc3)C2)c1
COC(=O)c1c2CCOc2c(C[C@@H](C)N)c2CCOc12
C[C@@H](N)[C@H](O)c1c2CCOc2c(Br)c2CCOc12
COCCOCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12
C[C@@H](N)Cc1c2CCOc2c(CCC(O)=O)c2CCOc12
C[C@@H](N)Cc1c2CCOc2c(COCC(=O)Oc2ccccc2)c2CCOc12
C[C@@H](N)Cc1c2CCOc2c(-c2nc(C)no2)c2CCOc12
C[C@@H](N)Cc1c2CCOc2c(CO)c2CCOc12
COCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12
C[C@@H](N)Cc1c2ccoc2c(Cc2nc(C)no2)c2ccoc12
C[C@@H](N)Cc1c2CCOc2c(Cc2nc(C)no2)c2CCOc12
COCc1c2ccoc2c(C[C@@H](C)N)c2ccoc12
C[C@@H](N)Cc1c2CCOc2c(CCc2nc(C)no2)c2CCOc12
C[C@@H](N)Cc1c2CCOc2c(CC(O)=O)c2CCOc12
COC(=O)CCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12
C[C@@H](N)[C@@H](O)c1c2CCOc2c(Br)c2CCOc12
C[C@@H](N)Cc1c2ccoc2c(CO)c2ccoc12
CC[C@@H]1O[C@@](\C=C\C2CC2)(c2c(F)c(F)ccc2NC1=O)C(F)(F)F |r|
Clc1ccc(cc1)-c1ccc(CNC(=O)Nc2ccc(CN3CCCCC3)cc2)cc1
CN(C(=O)\C=C\c1ccc(cc1)-c1ccc(Cl)cc1)c1ccc(CN2CCCCC2)cc1
Clc1ccc(cc1)-c1ccc(OCC(=O)Nc2ccc(CN3CCCCC3)cc2)cc1
Clc1ccc(cc1)-c1ccc(CCC(=O)Nc2ccc(CN3CCCCC3)cc2)cc1
CN(CCCc1ccc(cc1)-c1ccc(Cl)cc1)c1ccc(CN2CCCCC2)cc1
Clc1ccc(cc1)-c1ccc(\C=C\C(=O)Nc2ccc(CN3CCCCC3)cc2)cc1
Clc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCCC3)cc2)cc1
Clc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCCC3)cc2)nn1
Fc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCCC3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCCC3)cc2)nn1
N#Cc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCCC3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCC3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN(C)C)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCOCC3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCCC(O)C3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCC(O)CC3)cc2)nn1
COc1ccc(cc1)-c1ccc(CCCNc2ccc(CN3CCC(CC3)NC(C)=O)cc2)nn1
OC1CCN(Cc2ccc(NCCCc3ccc(OCc4ccccc4)nn3)cc2)CC1
OC1CCN(Cc2ccc(NCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1
CC(=O)NC1CCN(Cc2ccc(NCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1
O[C@@H]1CCCN(Cc2ccc(OCCCc3ccc(nn3)-c3ccc(Cl)cc3)cc2)C1 |r|
OCC1CCN(Cc2ccc(OCCCc3ccc(nn3)-c3ccc(Cl)cc3)cc2)CC1
O[C@@H]1CCCN(Cc2ccc(OCCCc3ccc(Oc4ccccc4)nn3)cc2)C1 |r|
OC1CCN(Cc2ccc(OCCCc3ccc(nn3)-c3ccc(Cl)cc3)cc2)CC1
OCC1CCN(Cc2ccc(OCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1
OC1CCN(Cc2ccc(OCCCc3ccc(nn3)-c3ccc(F)cc3)cc2)CC1
CC(=O)NC1CCN(Cc2ccc(OCCCc3ccc(nn3)-c3ccc(F)cc3)cc2)CC1
CC(=O)NC1CCN(Cc2ccc(OCCCc3ccc(Cc4ccccc4)nn3)cc2)CC1
CC(=O)NC1CCN(Cc2ccc(OCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1
COc1cc(ccc1OCCN1CCCC1)-n1cc(O)n(-c2ccc(Oc3ccccc3)cc2)c1=O
O=C1N\C(=C/c2ccc(CN3CCCC3)cc2)C(=O)N1c1ccc(Oc2ccccc2)cc1
Clc1ccc(cc1)-c1ccc(cc1)C(=O)NCCc1ccc(CN2CCCC2)cc1
CC(=O)N1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(Cl)cc3)cc2)CC1
CC(=O)NC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1
CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1
CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1
CCNC(=O)N(C)Cc1ccc(CCNC(=O)c2ccc(cc2F)-c2ccc(Cl)cc2)cc1
Clc1ccc(cc1)-c1ccc(nc1)C#Cc1ccc(OCCN2CCCC2)cc1
CC1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1
NC(=O)C1CCN(CCOc2ccc(cc2)C#Cc2ccc(cn2)-c2ccc(Cl)cc2)CC1
CC1CCN(CCOc2ccc(cc2)C#Cc2ncc(cc2F)-c2ccc(Cl)cc2)CC1
OC[C@H]1CCCN1CCOc1ccc(cc1)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r|
Cc1cc(ccc1OCCN1CCC[C@H]1CO)C#Cc1ccc(cn1)-c1ccc(Cl)cc1 |r|
CN1CCc2cccc-3c2[C@H]1Cc1ccc(CO)c(O)c-31
COc1cc2CCN(C)[C@@H]3Cc4ccc(C)c(O)c4-c(c1)c23
FCc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
Cc1cccc(n1)-c1ccc(cc1)C(=O)NC\C=C\CN1CCN(CC1)c1cccc(Cl)c1Cl
O=C(NC/C=C/C[N+]2([O-])CCN(c1cccc(Cl)c1Cl)CC2)c4ccc(c3ccccn3)cc4
Clc1cccc(N2CCN(C\C=C\CNC(=O)c3ccc(cc3)-c3ccccn3)CC2)c1Cl
COc1ccccc1N1CCN(C\C=C\CNC(=O)c2ccc(cc2)-c2ccccn2)CC1
CC(=O)OC(CCNC(=O)c1ccc(cc1)-c1ccccn1)CN1CCN(CC1)c1cccc(Cl)c1Cl |w:4.23|
COc1ccccc1N1CCN(CC(O)CCNC(=O)c2ccc(cc2)-c2ccccn2)CC1 |w:13.14|
COc1ccccc1N1CCN(C\C=C\CNC(=O)c2ccc-3c(Cc4ccccc-34)c2)CC1
OC(CCN1CCN(CC1)c1cccc(Cl)c1Cl)CNC(=O)c1ccc(cc1)-c1ccccn1 |w:1.0|
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc-3c(Cc4ccccc-34)c2)CC1
OC(CCNC(=O)c1ccc(cc1)-c1ccccn1)CN1CCN(CC1)c1cccc(Cl)c1Cl |w:1.0|
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-c2ccccn2)CC1
Clc1cccc(N2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccn3)CC2)c1Cl
Clc1cccc(N2CCN(C\C=C\CNC(=O)c3ccc(cc3)-c3cccc(=O)[nH]3)CC2)c1Cl
O=C(NC/C=C/CN2CCN(c1cccc(Cl)c1Cl)CC2)c4ccc(c3cccc[n+]3[O-])cc4
Cc1cccnc1-c1ccc(cc1)C(=O)NC\C=C\CN1CCN(CC1)c1cccc(Cl)c1Cl
Clc1cccc(N2CCN(CCCCNC(=O)c3ccc-4c(Cc5ccccc-45)c3)CC2)c1Cl
Clc1cccc(N2CCN(C\C=C\CNC(=O)c3ccc-4c(Cc5ccccc-45)c3)CC2)c1Cl
OC(CCNC(=O)c1ccc-2c(Cc3ccccc-23)c1)CN1CCN(CC1)c1cccc(Cl)c1Cl |w:1.0|
Clc1cccc(N2CCN(C[C@@H]3C[C@@H]3CNC(=O)c3ccc(cc3)-c3ccccn3)CC2)c1Cl
Clc1cccc(N2CCN(C[C@H]3C[C@@H]3CNC(=O)c3ccc(cc3)-c3ccccn3)CC2)c1Cl
OCCN1CCN(CC1)c1nc(Nc2ccccc2F)c2ccccc2n1
CC(C)c1ccc(Nc2nc(nc3ccccc23)N2CCN(CCO)CC2)cc1
OCCN1CCN(CC1)c1nc(Nc2cccc(O)c2)c2ccccc2n1
Cc1ccc(Nc2nc(nc3ccccc23)N2CCN(CCO)CC2)c(C)c1
OCCN1CCN(CC1)c1nc(NCc2ccccc2)c2ccccc2n1
CN1CCN(CC1)c1ccc(C#N)c(NCc2ccccc2)c1
N[C@@]1(C[C@H](C[C@H]1C(O)=O)C(O)=O)C(O)=O
N[C@]1(C[C@H](C[C@H]1C(O)=O)C(O)=O)C(O)=O
N[C@@]1(C[C@@H](C[C@@H]1C(O)=O)C(O)=O)C(O)=O
N[C@]1(C[C@@H](C[C@@H]1C(O)=O)C(O)=O)C(O)=O
OCCN1CCN(CC1)c1nc(Nc2ccc(Cl)cc2)c2ccccc2n1
OCCN1CCN(CC1)c1nc(Nc2ccc(I)cc2)c2ccccc2n1
OCCN1CCN(CC1)c1nc(Nc2ccc(Br)cc2)c2ccccc2n1
COc1ccccc1Nc1nc(nc2ccccc12)N1CCN(CCO)CC1
COc1ccc(Nc2nc(nc3ccccc23)N2CCN(CCO)CC2)cc1
c1cc2c(cc1O)c(c[nH]2)C[C@@H](C(=O)O)N
Clc1ccc(Nc2nc(nc3ccccc23)N2CCNCC2)cc1
Fc1ccccc1Nc1nc(nc2ccccc12)N1CCOCC1
OCCN1CCN(CC1)c1nc(Nc2ccc(F)cc2)c2ccccc2n1
COc1ccc(Nc2nc(nc3ccccc23)N2CCN(CCO)CC2)c(OC)c1
Fc1ccccc1Nc1nc(nc2ccccc12)N1CCNCC1
COc1ccccc1Nc1nc(nc2ccccc12)N1CCNCC1
Ic1ccc(Nc2nc(nc3ccccc23)N2CCNCC2)cc1
Fc1ccc(Nc2nc(nc3ccccc23)N2CCOCC2)cc1
CC(C)c1ccc(Nc2nc(nc3ccccc23)N2CCNCC2)cc1
CC(C)(C)[C@@]1(O)CCN2C[C@@H]3c4ccccc4CCc4cccc([C@H]2C1)c34 |r|
CCCN1CCO[C@@H](C1)c1cccc(O)c1
COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCNCC1
CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1ccc(O)cc1 |w:1.0|
CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1ccccc1 |w:1.0|
CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1 |w:1.0|
CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(OCc2ccccc2)c1 |w:1.0|
O=C(Cc1ccccc1)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:10.10|
O=C(NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12)c1cccnc1 |w:3.2|
CC(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:4.3|
O=C(NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12)c1cccnc1 |w:3.2|
CC(C)C(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:6.5|
O=C(NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12)c1ccco1 |w:3.2|
Fc1ccc(cc1)C(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:10.10|
CCC(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:5.4|
O=C(NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12)c1ccccc1 |w:3.2|
NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:1.0|
CCCC(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:6.5|
Fc1ccc(cc1)C(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:10.10|
CC(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:4.3|
Clc1ccc(cc1)C(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:10.10|
O=C(NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12)C1CC1 |w:3.2|
O=C(CCc1ccccc1)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:11.11|
Cc1ccc(cc1)C(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:10.10|
O=C(NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12)c1ccno1 |w:3.2|
O=C(NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12)C1CC1 |w:3.2|
CCC(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:5.4|
CC(C)C(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:6.5|
FC(F)(F)C(=O)NC1CCc2cc(CCN3CCN(CC3)c3nsc4ccccc34)ccc12 |w:7.6|
CCCC(=O)NC1CCc2ccc(CCN3CCN(CC3)c3nsc4ccccc34)cc12 |w:6.5|
COc1ccccc1N1CCN(CCCNC(=O)c2cc3ccccn3n2)CC1
COc1ccccc1N1CCN(CCCCCNC(=O)c2cc3ccccn3n2)CC1
COc1ccccc1N1CCN(CCCCCNC(=O)c2cnn3ccccc23)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2cccn3nccc23)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2ccn3nccc3c2)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2cccc3ccnn23)CC1
Cc1c(nnn1Cc1ccccc1)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CCCCNC(=O)c2nnn(Cc3ccccc3)c2C)CC1
COc1ccccc1N1CCN(CCCCCNC(=O)c2nnn(Cc3ccccc3)c2C)CC1
CCCc1c(nnn1Cc1ccccc1)C(=O)NCCCCN1CCN(CC1)c1ccccc1OC
COc1ccc(Cn2nnc(C(=O)NCCCCN3CCN(CC3)c3ccccc3OC)c2C)cc1
COc1ccc(Cn2nnc(C(=O)NCCCCCN3CCN(CC3)c3ccccc3OC)c2C)cc1
CCCc1c(nnn1Cc1ccc(OC)cc1)C(=O)NCCCCN1CCN(CC1)c1ccccc1OC
COc1ccccc1N1CCN(CCCCNC(=O)c2nnn(Cc3ccccc3Br)c2C)CC1
COc1ccccc1N1CCN(CCCCCNC(=O)c2nnn(Cc3ccccc3Br)c2C)CC1
CCCc1c(nnn1Cc1ccccc1Br)C(=O)NCCCCN1CCN(CC1)c1ccccc1OC
CCCc1c(nnn1Cc1ccccc1Br)C(=O)NCCCCCN1CCN(CC1)c1ccccc1OC
COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Clc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4s3)CC2)c1Cl
COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
Clc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl
COc1ccccc1N1CCN(CCCc2cn(nn2)-c2ccn3nccc3c2)CC1
Clc1cccc(N2CCN(CCCc3cn(nn3)-c3ccn4ncc(C=O)c4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccn4ncc(C=O)c4c3)CC2)c1Cl
COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1
COc1ccccc1N1CCN(CCNC(=O)c2cnn3ccccc23)CC1
CCCc1c(nnn1Cc1ccccc1)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccc(Cn2nnc(C(=O)NCCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)c2C)cc1
Clc1cccc(N2CCN(CCc3cn(nn3)-c3ccn4ncc(C=O)c4c3)CC2)c1Cl
COc1ccccc1N1CCN(CCc2cn(nn2)-c2ccn3ncc(C=O)c3c2)CC1
Clc1cccc(N2CCN(CCc3cn(nn3)-c3ccn4nccc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCc3cn(nn3)-c3ccn4nccc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccn4nccc4c3)CC2)c1Cl
CC(N)Cc1cc(F)c(Br)cc1F
CC(N)Cc1c2ccccc2c(Br)c2ccccc12
CSc1c2OCCc2c(CC(C)N)c2CCOc12
CSc1cc(CC(C)N)c(SC)cc1C
COc1cc(CCN)cc(OC)c1OCCc1ccccc1
COc1cc2CC(N)CCOc2cc1Br
Nc1nc(c(s1)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)-c1ccc(F)cc1 |r|
COc1ccc(cc1)S(=O)(=O)NCCCN1CCN(CC1)c1cccc(c1)C(F)(F)F
COc1ccc(cc1)S(=O)(=O)NC(C)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F
Clc1ccc(cc1Cl)N1CCN(CCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
COc1ccccc1N1CCN(CCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
COc1ccc(cc1)S(=O)(=O)NCCCN1CCN(CC1)c1ccc(F)cc1
COc1ccc(cc1)S(=O)(=O)NCCCN1CCN(CC1)c1ccccc1OC
CC(N)Cc1c2CCCOc2c(Br)c2ccoc12
CC(N)Cc1c2CCOc2c(Br)c2CCCOc12
NCCc1c2CCOc2c(Br)c2CCCOc12
CC(N)Cc1c2OCCc2c(Br)c2OCCCc12
NCCc1c2OCCc2c(Br)c2OCCCc12
CC(N)Cc1c2CCCOc2c(Br)c2CCCOc12
NCCc1c2CCCOc2c(Br)c2CCCOc12
COc1ccccc1N1CCN(CCCCN2C(=O)C3C(C2=O)C2(CC(C)C3C(C)=C2)OC(C)=O)CC1 |c:32,TLB:29:28:20.19:25.24|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ncccn2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccccn2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccccc2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccc(F)cc2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCCN2CCN(Cc3ccccc3)CC2)C1=O |t:8,THB:10:9:13.12:1.2|
COc1ccccc1N1CCN(CCCCN2C(=O)C3C(C2=O)C2(C)CC(C)C3C(=O)C2)CC1 |TLB:30:29:20.19:26.25|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ncccn2)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccccn2)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccccc2)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCCN2CCN(CC2)c2ccc(F)cc2)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCCN2CCN(Cc3ccccc3)CC2)C1=O |THB:7:6:10.9:1.2|
COc1ccccc1N1CCN(CCCN2C(=O)C3C(C2=O)C2(CC(C)C3C(C)=C2)OC(C)=O)CC1 |c:31,TLB:28:27:19.18:24.23|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(CCCN2CCN(CC2)c2ccccc2)C1=O |t:8,THB:10:9:13.12:1.2|
COc1ccccc1N1CCN(CCCN2C(=O)C3C(C2=O)C2(C)CC(C)C3C(=O)C2)CC1 |TLB:29:28:19.18:25.24|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(CCCN2CCN(CC2)c2ccccc2)C1=O |THB:7:6:10.9:1.2|
COc1ccccc1N1CCN(CCCON2C(=O)C3C(C2=O)C2(CC(C)C3C(C)=C2)OC(C)=O)CC1 |c:32,TLB:29:28:20.19:25.24|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2ccccn2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2ccccc2)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2ccccc2F)C1=O |t:8,THB:10:9:13.12:1.2|
CC1CC2(OC(C)=O)C=C(C)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2cccc(Cl)c2)C1=O |t:8,THB:10:9:13.12:1.2|
COc1ccccc1N1CCN(CCCON2C(=O)C3C(C2=O)C2(C)CC(C)C3C(=O)C2)CC1 |TLB:30:29:20.19:26.25|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2ccccc2)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2ccccc2F)C1=O |THB:7:6:10.9:1.2|
CC1CC2(C)CC(=O)C1C1C2C(=O)N(OCCCN2CCN(CC2)c2cccc(Cl)c2)C1=O |THB:7:6:10.9:1.2|
COc1ccccc1N1CCN(CCCON2C(=O)C3C(C2=O)C2(CCC3C=C2)OC)CC1 |c:30|
COc1ccccc1N1CCN(CCCCN2C(=O)C3C(C2=O)C2(CC(=O)C3C(C)(C)C2)OC(C)=O)CC1 |TLB:26:25:20.19:28.31|
CCOC12CCC(C3C1C(=O)N(CCCCN1CCN(CC1)c1ccccc1OC)C3=O)C(=O)C2 |THB:33:32:8.7:5.4|
CCn1cc(CN2CCN(CC2)c2cccc3[nH]c(nc23)-c2ccc(cc2)C(C)(C)C)c(=O)[nH]c1=O
CN1CCN(C[C@H](c2cccc(OC(F)(F)F)c2)C2(O)CCCCC2)CC1 |r|
Fc1ccc(cc1)C(=O)CCCN1C2CCC1CN(CC2)c1ccc(Cl)cc1 |TLB:11:12:14.15:20.17.18.19,THB:21:18:14.15:12|
Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccc(Cl)cc1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ncccn1
Fc1ccc(cc1)C(=O)CCCN1C2CCC1CC(C2)c1ccccc1 |TLB:11:12:18.19.17:14.15|
OC1(CC2CCC(C1)N2CCCC(=O)c1ccc(F)cc1)c1ccccc1 |TLB:9:8:1.2.7:4.5,0:1:8:4.5|
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cc1
COc1ccccc1N1CCN(CCCSc2nc3ccccc3s2)CC1
COc1ccccc1N1CCN(CCCCCCSc2nc3ccccc3o2)CC1
COc1ccccc1N1CCN(CCCCSc2nc3ccccc3o2)CC1
COc1ccccc1N1CCN(CCCCSc2nc3ccccc3s2)CC1
C(CSc1nc2ccccc2s1)CN1CCN(CC1)c1ncccn1
C(CSc1nc2ccccc2o1)CN1CCN(CC1)c1ccccn1
C(CSc1nc2ccccc2s1)CN1CCN(CC1)c1ccccn1
Clc1ncccc1Oc1ccc(NC(=O)c2c[nH]c3ccccc23)cn1
O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Cc1ccc2c(c[nH]c2c1)C(=O)Nc1ccc(Oc2cccnc2C)nc1
COc1ccc2[nH]cc(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2c1
Cc1ccc2[nH]cc(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2c1
CCOC(=O)N(Cc1ccccc1-c1ccccc1)[C@H]1CCNC1 |r|
Clc1ccc(cc1)C1=NN(C[C@@H]1c1ccccc1)C(=N)NS(=O)(=O)c1ccc(cc1)C#N |r,t:8|
COc1cccc2Cc3ccccc3C(CN)c12
COc1ccc2Cc3ccccc3C(CN)c2c1
COc1cccc2C(CN)c3ccccc3Cc12
OC1(CC2CCC(C1)N2Cc1c[nH]c2ccccc12)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,0:1:4.5:8,THB:19:1:4.5:8|
OC1(CC2CCC(C1)N2Cc1coc2ccccc12)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,0:1:4.5:8,THB:19:1:4.5:8|
OC1(CC2CCC(C1)N2Cc1csc2ccccc12)c1ccc(Cl)cc1 |TLB:9:8:4.5:2.1.7,0:1:4.5:8,THB:19:1:4.5:8|
OC1(CC2CCC(C1)N2Cc1c[nH]c2ccccc12)c1ccc(Cl)c(Cl)c1 |TLB:9:8:4.5:2.1.7,0:1:4.5:8,THB:19:1:4.5:8|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(O)c-31 |r|
CCCN1CCc2cccc3-c4cc(OC(=O)CCCC(=O)Oc5cccc6C[C@H]7N(CCC)CCc8cccc(c78)-c56)ccc4C[C@@H]1c23 |r|
CCCN1CCc2cccc3-c4cc(OC(=O)CCC(=O)Oc5cccc6C[C@H]7N(CCC)CCc8cccc(c78)-c56)ccc4C[C@@H]1c23 |r|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OC(=O)CNC(=O)OCc2ccccc2)c-31 |r|
CCCCCCC(=O)Oc1cccc2C[C@H]3N(CCC)CCc4cccc(c34)-c12 |r|
CCCCCC(=O)Oc1cccc2C[C@H]3N(CCC)CCc4cccc(c34)-c12 |r|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OC(=O)CCC)c-31 |r|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OC(=O)CC)c-31 |r|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OC(C)=O)c-31 |r|
CCCCC(=O)Oc1cccc2C[C@H]3N(CCC)CCc4cccc(c34)-c12 |r|
Oc1cc2C(CNCCc2c(c1O)-c1ccc2ccccc2c1)c1ccccc1
CN1CCc2c(cc(O)c(O)c2-c2cccc(C)c2)C(C1)c1cccc(C)c1
CN1CCc2c(cc(O)c(O)c2-c2ccc3ccccc3c2)C(C1)c1cccc(C)c1
CC(N(C)C)c1ccccc1Oc1ccc(Cl)c(Cl)c1
CN(C)Cc1ccccc1Oc1ccc(C)cc1
CN(C)Cc1ccc(cc1Oc1ccc(Cl)c(Cl)c1)C(F)(F)F
CN(C)Cc1ccccc1Oc1ccc(F)c(F)c1
CNCc1cc(F)ccc1Oc1ccc(C)c(C)c1
CNCc1ccccc1Oc1ccc(C)c(C)c1
CNCc1ccccc1Oc1ccc(Cl)cc1
CNC(C)c1ccccc1Oc1ccc(C)cc1
CNCc1ccc(cc1Oc1ccc(Cl)c(Cl)c1)C(F)(F)F
CNCc1ccc(Cl)cc1Oc1ccc(Cl)c(Cl)c1
CNC(C)c1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccc(F)cc1Oc1ccc(Cl)c(Cl)c1
CNC(C)c1ccccc1Oc1ccc(Cl)c(Cl)c1
CNC(C)c1ccccc1Oc1ccc(Cl)cc1
CNCc1cc(OC)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(F)ccc1Oc1ccc(Cl)cc1
CNC(C)c1cc(F)ccc1Oc1ccc(Cl)cc1
CN(C)Cc1cc(C)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccc(Br)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(Br)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(OC)c(OC)cc1Oc1ccc(Cl)c(Cl)c1
COc1ccc(CN(C)C)c(Oc2ccc(Cl)c(Cl)c2)c1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#N
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)S(=O)(=O)NC
CNCc1cc(C)c(C)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccc(cc1Oc1ccc(Cl)c(Cl)c1)C#N
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(N)=O
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(F)(F)F
CNCc1cc(F)c(Cl)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccc(OC)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(F)ccc1Oc1ccc(Cl)c(F)c1
CNCc1cc(F)ccc1Oc1ccc(F)c(Cl)c1
CNC(C)c1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(F)(F)F
CNC(C)c1cc(C)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(F)ccc1Oc1ccc(cc1)-c1ccccc1
CNC(C)c1ccc(OC)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(F)c(OC)cc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccc(cc1Oc1ccc(Cl)cc1)C(F)(F)F
CNCc1cc(ccc1Oc1ccc(C)cc1)C(F)(F)F
CNCc1ccc(Cl)cc1Oc1ccc(C)c(C)c1
CNCc1ccc(Cl)cc1Oc1ccc(C)cc1
CCc1cc(Oc2ccc(F)cc2CNC)ccc1Cl
CCc1cc(Oc2cc(Cl)ccc2CNC)ccc1Cl
CNCc1ccc(Cl)cc1Oc1ccc(Cl)cc1
CNC(C)c1ccc(Cl)cc1Oc1ccc(C)cc1
CNC(C)c1ccc(Cl)cc1Oc1ccc(C)c(C)c1
CNCc1cc(Cl)ccc1Oc1ccc(C)c(C)c1
CNCc1cc(Cl)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1cc(Cl)ccc1Oc1ccc(Cl)cc1
CNCc1ccc(Cl)cc1Oc1ccc(C)c(Cl)c1
CNCc1ccc(Cl)cc1Oc1ccc(Cl)c(C)c1
CNCc1ccc(Cl)cc1Oc1cccc(Cl)c1
CNCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1
CNCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1
CNCc1ccc(Cl)cc1Oc1ccc(F)c(c1)C(F)(F)F
CNCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1
CNCc1cc(F)ccc1Oc1ccccc1
CN(C)Cc1ccccc1Oc1ccc(Cl)c(Cl)c1
CN(C)Cc1ccccc1Oc1ccc(Cl)cc1
CNCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1
CN(C)Cc1cc(N)ccc1Oc1ccc(Cl)c(Cl)c1
CNCc1ccccc1Oc1ccc(Cl)c(Cl)c1
CN(C)Cc1cc(CC(N)=O)ccc1Oc1ccc(Cl)c(Cl)c1
CSc1ccc(Oc2ccccc2CN(C)C)cc1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(-c3nc4ccccc4o3)c(F)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2cccc(c2)-c2nc3ccccc3o2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(Cc3nc4ccccc4o3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc(cc2)-c2nc3ccccc3o2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3s2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CCc3nc4ccccc4o3)cc2)CC1
CC(c1nc2ccccc2o1)c1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
COc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1-c1nc2ccccc2o1
Cc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)-c1nc2ccccc2o1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(cc2)-c2nc3cc(Cl)ccc3o2)CC1
Cc1ccc2oc(nc2c1)-c1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCN(CC1)c1nsc2ccccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3o2)CC1
Fc1ccc(C(=O)C2CCN(CCCOc3ccc(cc3)-c3nc4ccccc4o3)CC2)c(F)c1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCN(CC1)c1ncccn1
COc1ccccc1N1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3o2)CC1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCC(CC1)c1nc2ccccc2s1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCC(CC1)c1nc2ccccc2o1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCN(CC2COc3ccccc3O2)CC1
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCN(CC1)c1ccccn1
Cc1cccc(N2CCN(CCCOc3ccc(cc3)-c3nc4ccccc4o3)CC2)c1C
FC(F)(F)c1cccc(c1)N1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3o2)CC1
Clc1cccc(N2CCN(CCCOc3ccc(cc3)-c3nc4ccccc4o3)CC2)c1Cl
C(COc1ccc(cc1)-c1nc2ccccc2o1)CN1CCN(CC1)c1ccccc1
COc1ccccc1N1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3[nH]2)CC1
COc1cccc2cc3CN(CCCCN4CCn5c(cc6ccccc56)C4=O)CCn3c12
Clc1cccc(N2CCN(CCCCCOc3cc4ccccc4cn3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ccc4cccnc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCN3CCn4c(cc5ccccc45)C3=O)CC2)c1Cl
Clc1ccc(N2CCN(CCCCN3CCn4c(cc5ccccc45)C3=O)CC2)c(Cl)c1
O=C1N(CCCCN2CCN(CC2)c2cccc(c2)C#N)CCn2c1cc1ccccc21
Clc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4cn3)CC2)c1Cl
Clc1cccc(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3cn2)CC1
COc1cccc2cc3CN(CCCCNC(=O)C4=NCc5ccccc5C4)CCn3c12 |t:18|
COc1cccc2[nH]c3CN(CCCCNC(=O)C4=NCc5ccccc5C4)CCc3c12 |t:18|
Clc1cccc(N2CCN(CCCCOc3cc4ccccc4cn3)CC2)c1Cl
CC(C)c1ccccc1OCCN1CCC(CC1)N(C)S(=O)(=O)c1ccccc1
CC(C)c1ccccc1OCCN1CCC(CC1)N(C)S(=O)(=O)c1cccc(F)c1
CC(C)c1ccccc1OCCN1CCC(CC1)N(C)S(=O)(=O)c1ccc(F)cc1
CC(C)c1ccccc1OCCN1CCC(CC1)N(C)S(=O)(=O)c1cnn(C)c1
CN(C1CCN(CCOc2ccccc2C(C)(C)C)CC1)S(=O)(=O)c1ccccc1
CN(C1CCN(CCOc2ccccc2C(C)(C)C)CC1)S(=O)(=O)c1cccc(F)c1
CN(C1CCN(CCOc2ccccc2C(C)(C)C)CC1)S(=O)(=O)c1ccc(F)cc1
CN(C1CCN(CCOc2ccccc2C(C)(C)C)CC1)S(=O)(=O)c1cnn(C)c1
CN(C1CCN(CCOc2ccccc2-c2ccccc2)CC1)S(=O)(=O)c1ccccc1
CN(C1CCN(CCOc2ccccc2-c2ccccc2)CC1)S(=O)(=O)c1ccc(F)cc1
CN(C1CCN(CCOc2ccccc2-c2ccccc2)CC1)S(=O)(=O)c1cnn(C)c1
CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cccc(F)c1
CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1ccc(F)cc1
CC(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1cnn(C)c1
CC(C)(C)c1ccccc1OCCN1CCC(CC1)N(CC1CC1)S(=O)(=O)c1ccc(F)cc1
Cn1cc(cn1)S(=O)(=O)N(CC1CC1)C1CCN(CCOc2ccccc2C(C)(C)C)CC1
Fc1ccc(cc1)S(=O)(=O)N(CC1CC1)C1CCN(CCOc2ccccc2-c2ccccc2)CC1
Cn1cc(cn1)S(=O)(=O)N(CC1CC1)C1CCN(CCOc2ccccc2-c2ccccc2)CC1
Clc1cccc(N2CCN(CCCCN3CCCc4ccccc4C3=O)CC2)c1Cl
Clc1ccccc1OC1CCN(CC1)S(=O)(=O)c1ccc2CCNCCc2c1
NC[C@H]1C[C@@H]1c1ccccc1 |r|
NC[C@H]1C[C@@H]1c1cccc(c1)C#C |r|
NC[C@H]1C[C@@H]1c1ccccc1Br |r|
Cc1ccc(cc1)[C@H]1C[C@@H]1CN |r|
Cc1cc(ccc1F)[C@H]1C[C@@H]1CN |r|
Cc1cccc(Cl)c1[C@H]1C[C@@H]1CN |r|
Cc1ccc([C@H]2C[C@@H]2CN)c(Br)c1 |r|
Cc1cccc([C@H]2C[C@@H]2CN)c1C |r|
Cc1ccc(cc1C)[C@H]1C[C@@H]1CN |r|
Cc1ccc(Cl)c([C@H]2C[C@@H]2CN)c1F |r|
NC[C@H]1C[C@@H]1c1ccc(F)cc1Cl |r|
NCC1CC1c1ccccc1Br
Cc1cccc(c1)[C@H]1C[C@@H]1CN |r|
NC[C@H]1C[C@@H]1c1ccc(F)cc1 |r|
NC[C@H]1C[C@@H]1c1ccccc1Cl |r|
NC[C@H]1C[C@@H]1c1cccc(c1)C(F)(F)F |r|
NC[C@H]1C[C@@H]1c1cccc(Br)c1 |r|
NC[C@H]1C[C@@H]1c1cccc(F)c1 |r|
NC[C@H]1C[C@@H]1c1cccc(Cl)c1 |r|
NC[C@H]1C[C@@H]1c1ccc(Cl)cc1 |r|
NC[C@H]1C[C@@H]1c1ccccc1F |r|
NC[C@H]1C[C@@H]1c1ccc(Br)cc1 |r|
NC[C@H]1C[C@@H]1c1c(F)cccc1F |r|
NCC1CC1c1ccccc1
Cc1ccccc1[C@H]1C[C@@H]1CN |r|
COc1ccccc1[C@H]1C[C@@H]1CN |r|
NC[C@H]1C[C@@H]1c1ccccc1O |r|
COc1cccc(c1)[C@H]1C[C@@H]1CN |r|
NC[C@H]1C[C@@H]1c1cccc(O)c1 |r|
NC[C@H]1C[C@@H]1c1cccc(F)c1F |r|
NC[C@H]1C[C@@H]1c1ccc(F)cc1F |r|
NC[C@H]1C[C@@H]1c1ccc(F)c(F)c1 |r|
NC[C@H]1C[C@@H]1c1ccc(Cl)cc1F |r|
NC[C@H]1C[C@@H]1c1cccc(Cl)c1Cl |r|
NC[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl |r|
Brc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
C=CCN(CCc1c[nH]c2ccccc12)CC=C
Fc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
COc1cc2CCN(C)C3Cc4cc5OCOc5cc4-c(c1OCc1ccccc1)c23
CC(Oc1ccc(CN2C[C@@H](C)OC2=O)cc1)C1CCCCC1 |r|
C[C@@H]1CN(Cc2ccc(nc2)-c2ccc(F)c(F)c2)C(=O)O1 |r|
C[C@@H]1CN(Cc2ccc(nc2)-c2ccc(OC(F)(F)F)cc2F)C(=O)O1 |r|
C[C@@H]1CN(Cc2ccc(cc2)-c2ccc(F)cc2F)C(=O)O1 |r|
C[C@@H]1CN(Cc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2F)C(=O)O1 |r|
C[C@@H]1CN(Cc2ccc(cc2)-c2ccc(F)c(Cl)c2)C(=O)O1 |r|
Cc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
COc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
Clc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1
COc1ccc(CCN2CCC(CC2)C(O)c2cccc(OCCF)c2OC)cc1
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1
COc1ccc(CCN2CCC(CC2)C(=O)c2cccc(OCCF)c2OC)cc1
COc1c(OCCF)cccc1C(O)C1CCN(CC1)C(=O)Cc1ccccc1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccccc2)CC1
COc1c(O)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1
COc1cccc(C(O)C2CCN(Cc3ccc(F)cc3)CC2)c1OC
COc1cccc(C(O)C2CCN(CCc3ccc(cc3)[N+]([O-])=O)CC2)c1OC
COc1ccc(CCN2CCC(CC2)C(O)c2cccc(OC)c2OC)cc1
COc1cccc(C(O)C2CCN(CCc3ccc(C)cc3)CC2)c1OC
COc1c(O)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(O)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(N)cc2)CC1
CN(C)CCC(Oc1ccc(NC(=O)Nc2ccc3n(C)ccc3c2)cc1)c1ccccc1
COc1ccc(NC(=O)Nc2ccc(OC(CCN(C)C)c3ccccc3)cc2)cc1Cl
CN(C)CCC(Oc1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cc1)c1ccccc1
CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(I)cc1
CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)Nc2ccc3n(C)ccc3c2)cc1
CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)N1CCN(CC1)c1cccc(Cl)c1
ONC(=N)CN1CCN(CC1)c1nc2cc(F)ccc2n2cccc12
N[C@@H](CN1CCN(CC1)c1nc2cc(F)ccc2n2cccc12)C(O)=O |r|
N[C@H](CN1CCN(CC1)c1nc2cc(F)ccc2n2cccc12)C(O)=O |r|
OC(=O)CN1CCN(CC1)c1ccc2ccccc2n1
CN1CCN(CC1)c1nc2cc(F)ccc2n2cccc12
CN1CCN(CC1)c1nc2cccc(C)c2n2cccc12
Fc1cccc(c1)S(=O)(=O)NC1CCN(CCOc2ccccc2C2CCCC2)CC1
CC(C)c1cccc(OCCN2C3CCC2CC(C3)NS(=O)(=O)c2cccc(F)c2)c1
CC(C)c1cccc(OCCN2C3CCC2CC(C3)NS(=O)(=O)c2ccc(F)cc2)c1
Clc1cccc(c1)S(=O)(=O)NC1CC2CCC(C1)N2CCOc1cccc(c1)-c1ccccc1
CC(C)c1ccccc1OCCN1CCC(CC1)NS(=O)(=O)c1cccc(F)c1
O=C(NCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccncc1
O=C(NCCN1CCN(CC1)C(=O)c1ccco1)c1ccncc1
Clc1ccc(cc1)C(N1CCN(CCNC(=O)c2ccncc2)CC1)c1ccccc1
Fc1ccc(cc1)C(N1CCN(CCNC(=O)c2ccncc2)CC1)c1ccc(F)cc1
O=C(NCCN1CCN(CC1)c1cccc2ccccc12)c1ccncc1
O=C(NCCCN1CCN(CC1)c1ccccc1)c1ccncc1
COc1ccccc1N1CCN(CCCNC(=O)c2ccncc2)CC1
COc1ccc(cc1)N1CCN(CCCNC(=O)c2ccncc2)CC1
CCOc1ccccc1N1CCN(CCCNC(=O)c2ccncc2)CC1
O=C(NCCCN1CCN(CC1)c1ccccc1C#N)c1ccncc1
Cc1ccccc1N1CCN(CCCNC(=O)c2ccncc2)CC1
Cc1cccc(N2CCN(CCCNC(=O)c3ccncc3)CC2)c1C
Clc1ccccc1N1CCN(CCCNC(=O)c2ccncc2)CC1
Clc1cccc(c1)N1CCN(CCCNC(=O)c2ccncc2)CC1
Clc1ccc(cc1)N1CCN(CCCNC(=O)c2ccncc2)CC1
Clc1ccc(cc1Cl)N1CCN(CCCNC(=O)c2ccncc2)CC1
Fc1ccccc1N1CCN(CCCNC(=O)c2ccncc2)CC1
Fc1ccc(cc1)N1CCN(CCCNC(=O)c2ccncc2)CC1
O=C(NCCCN1CCN(CC1)c1ccccn1)c1ccncc1
O=C(NCCCN1CCN(CC1)c1ncccn1)c1ccncc1
O=C(NCCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccncc1
O=C(NCCCN1CCN(CC1)C(=O)c1ccco1)c1ccncc1
Clc1ccc(cc1)C(N1CCN(CCCNC(=O)c2ccncc2)CC1)c1ccccc1
Fc1ccc(cc1)C(N1CCN(CCCNC(=O)c2ccncc2)CC1)c1ccc(F)cc1
O=C(NCCCN1CCN(CC1)c1cccc2ccccc12)c1ccncc1
Clc1ccc(cc1Cl)N1CCN(CCNC(=O)c2ccncc2)CC1
Fc1ccc(cc1)N1CCN(CCNC(=O)c2ccncc2)CC1
O=C(NCCN1CCN(CC1)c1ccccc1)c1ccncc1
COc1ccccc1N1CCN(CCNC(=O)c2ccncc2)CC1
COc1ccc(cc1)N1CCN(CCNC(=O)c2ccncc2)CC1
CCOc1ccccc1N1CCN(CCNC(=O)c2ccncc2)CC1
O=C(NCCN1CCN(CC1)c1ccccc1C#N)c1ccncc1
Cc1ccccc1N1CCN(CCNC(=O)c2ccncc2)CC1
Cc1cccc(N2CCN(CCNC(=O)c3ccncc3)CC2)c1C
Clc1ccccc1N1CCN(CCNC(=O)c2ccncc2)CC1
Clc1cccc(c1)N1CCN(CCNC(=O)c2ccncc2)CC1
Clc1ccc(cc1)N1CCN(CCNC(=O)c2ccncc2)CC1
Fc1ccccc1N1CCN(CCNC(=O)c2ccncc2)CC1
O=C(NCCN1CCN(CC1)c1ccccn1)c1ccncc1
O=C(NCCN1CCN(CC1)c1ncccn1)c1ccncc1
COc1ccccc1N1CCN(CCCCCC(=O)n2c3ccccc3c3ccccc23)CC1
COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc23)CC1
Oc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc23)CC1
OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Fc1ccc(OCCCN2CCN(CC2)c2ncc(F)cn2)cc1
Fc1ccc(cc1)C(CCCN1CCN(CC1)c1ncc(F)cn1)NC(=O)c1ccc(F)cc1
Fc1ccc(CCCCN2CCN(CC2)c2ncc(F)cn2)cc1
NC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)c2ccccc12
OC(CCCN1CCN(CC1)c1ncc(F)cn1)(C1CCCCC1)c1ccc(F)cc1
OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)c2ccccc12
Fc1ccc(cc1)C(CCCN1CCN(CC1)c1ncc(F)cn1)NS(=O)(=O)c1ccc(F)cc1
Fc1cnc(nc1)N1CCN(CCCCc2ccc(F)c3ccccc23)CC1
CC(=O)OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Fc1ccc(cc1)S(=O)(=O)NC(CCCN1CCN(CC1)c1ncc(F)cn1)C1CCCCC1
Fc1ccc(cc1)C(=O)NC(CCCN1CCN(CC1)c1ncc(F)cn1)C1CCCCC1
NC(CCCN1CCN(CC1)c1ncc(F)cn1)C1CCCCC1
CC1(C)NC(Nc2cccc(Br)c2)=NC(N)=N1 |c:13,16|
CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|
CCOC(=O)c1cccc(NC2=NC(=NC3(CCCCC3)N2)N(C)C)c1 |c:13,t:11|
NC1=NC2(CCCCC2)NC(Nc2cccc(Br)c2)=N1 |c:20,t:1|
CCNC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|
COc1cc(F)c(F)cc1C1CC1CN
NCC1CC1c1cc(F)c(F)cc1OCCF
NCC1CC1c1cc(F)c(F)cc1OCC=C
COc1ccc(F)c(F)c1C1CC1CN
NCC1CC1c1c(F)c(F)ccc1OCCF
COc1cc(F)c(Cl)cc1C1CC1CN
NCC1CC1c1cc(Cl)c(F)cc1OCCF
COc1ccc(Cl)c(F)c1C1CC1CN
NCC1CC1c1c(F)c(Cl)ccc1OCCF
NCC1CC1c1c(F)c(Cl)ccc1OCC=C
COc1cc(Cl)c(Cl)cc1C1CC1CN
NCC1CC1c1cc(Cl)c(Cl)cc1OCCF
NCC1CC1c1cc(Cl)c(Cl)cc1OCC=C
COc1ccc(Cl)c(Cl)c1C1CC1CN
NCC1CC1c1c(Cl)c(Cl)ccc1OCCF
NCC1CC1c1c(Cl)c(Cl)ccc1OCC=C
COc1ccc(F)c(Cl)c1C1CC1CN
NCC1CC1c1c(Cl)c(F)ccc1OCCF
CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
CN1CCN(CC1)c1nccc(n1)-c1ccccc1
CN1CCN(CC1)c1nc(cc(n1)-c1cccs1)-c1cccs1
CN1CCN(CC1)c1nc(cc(n1)-c1cccs1)-c1ccoc1
CN1CCN(CC1)c1nc(C)cc(n1)-c1ccoc1
CN1CCN(CC1)c1nccc(n1)-c1cccs1
CN1CCN(CC1)c1nccc(n1)-c1ccco1
CN1CCN(CC1)c1nc(cc(n1)-c1ccoc1)-c1ccoc1
CN1CCN(CC1)c1nc(cc(n1)-c1ccco1)-c1ccoc1
CN1CCN(CC1)c1nccc(n1)-c1ccoc1
CN1CCN(CC1)c1nc(cc(n1)-c1ccccc1)-c1ccoc1
COc1ccccc1N1CCN(CCCCc2ccc3N(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)C(=O)OCc3c2)CC1
[#6]-[#8]-c1ccccc1-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-c2ccc3n(-[#6]-[#6]-[#7]-4-[#6]-[#6]\[#6](-[#6]-[#6]-4)=[#6](\c4ccc(F)cc4)-c4ccc(F)cc4)c(=O)oc3c2)-[#6]-[#6]-1
Fc1ccc(cc1)C(=O)C1CCN(CCn2c3ccc(CCCCN4CCOCC4)cc3sc2=O)CC1
COc1ccccc1N1CCN(CCc2ccc3n(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCCCc2ccc3n(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)c(=O)oc3c2)CC1
[#6]-[#8]-c1ccccc1-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-c2ccc3n(-[#6]-[#6]-[#7]-4-[#6]-[#6]\[#6](-[#6]-[#6]-4)=[#6](\c4ccc(F)cc4)-c4ccc(F)cc4)c(=O)sc3c2)-[#6]-[#6]-1
COc1ccccc1N1CCN(CCCc2ccc3n(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)c(=O)sc3c2)CC1
COc1ccccc1N1CCN(CCCCc2ccc3n(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)c(=O)sc3c2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCN2C(=O)OCc3cc(CCCCN4CCOCC4)ccc23)CC1
[#6]-[#8]-c1ccccc1-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-c2ccc3-[#7](-[#6]-[#6]-[#7]-4-[#6]-[#6]\[#6](-[#6]-[#6]-4)=[#6](\c4ccc(F)cc4)-c4ccc(F)cc4)-[#6](=O)-[#8]-[#6]-c3c2)-[#6]-[#6]-1
Fc1ccc(cc1)C(=O)C1CCN(CCn2c3ccc(CCCCN4CCN(CC4)c4cccc(c4)C(F)(F)F)cc3sc2=O)CC1
Fc1ccc(NC(=S)Nc2cccc(c2)C(F)(F)F)cc1Cl
COc1ccc(NC(=S)Nc2cccc(c2)C(F)(F)F)cc1
FC(F)(F)c1cccc(NC(=S)Nc2ccccc2Cl)c1
FC(F)(F)c1cccc(NC(=S)NCCc2ccccc2)c1
FC(F)(F)c1cccc(NC(S)=NCc2ccccc2)c1
[O-][N+](=O)c1cc(NC(=S)Nc2ccccc2)ccc1Cl
[O-][N+](=O)c1cc(NC(=S)Nc2ccccc2Cl)ccc1Cl
[O-][N+](=O)c1cc(NC(=S)NC(=O)c2ccccc2)ccc1Cl
[O-][N+](=O)c1cc(NC(=S)NCc2ccccc2)ccc1Cl
CC(NC(=S)Nc1ccc(Cl)c(c1)[N+]([O-])=O)c1ccccc1
CNC(=O)c1cccc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
CNC(=O)c1ccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)cc1
CNC(=O)c1ccccc1OCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CC(=O)Nc1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2nsc3ccccc23)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccc1F
Cc1ccc2Nc3ncccc3N=C(N3CCN(CC3)c3cccc(c3)C(F)(F)F)c2c1 |t:13|
CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:8|
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc3sccc23)c1
CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12 |t:8|
CN1CCCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:9|
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc3sccc23)ccc1F
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc3OC(F)(F)Oc23)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc3OC(F)(F)Oc23)ccc1F
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
NC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CCNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1F
CCCCCNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc1C
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc1F
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1C
CNC(=O)c1ccc(OC)c(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc1Cl
CNC(=O)c1cc(C)cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)cc(c1)C(C)=O
CNC(=O)c1ccc(Cl)c(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cc(F)cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1OC
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1F
COc1ccc(CCN(CCCc2ccccc2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccc(F)cc2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccc(Cl)cc2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccc(Br)cc2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccc(I)cc2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2cccc(F)c2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2cccc(Cl)c2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2cccc(Br)c2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2cccc(I)c2)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccccc2F)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccccc2Cl)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccccc2Br)CCc2ccc3OCOc3c2)cc1OC
COc1ccc(CCN(CCCc2ccccc2I)CCc2ccc3OCOc3c2)cc1OC
NC(=O)c1ccc(cc1)C(=O)CCCN1CCc2ccccc2C1
COc1ccc(cc1)C(=O)CCCN1CCc2ccccc2C1
O=C(CCCN1CCc2ccccc2C1)c1ccccc1
O=C(CCCN1CCc2ccccc2C1)c1ccc(cc1)C#N
[O-][S+](CCCN1CCc2ccccc2C1)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)CCCN1CCc2ccccc2C1
Fc1ccc(OCCCN2CCc3ccccc3C2)cc1
Fc1ccc(SCCCN2CCc3ccccc3C2)cc1
Fc1ccc2CC(CCN3CCc4ccccc4C3)Cc2c1
Fc1ccc(CCCCN2CCc3ccccc3C2)cc1
C(CCc1c[nH]c2ccccc12)CN1CCc2ccccc2C1
O=C1N(CCCCN2CCC3CCCCC3C2)C(=O)c2ccccc12
Oc1ccc(cc1)C(=O)CCCN1CCc2ccccc2C1
O=C1NCN(c2ccccc2)C11CCN(CCCCc2nc3ccccc3s2)CC1
Clc1ccc2sc(CCCCN3CCC4(CC3)N(CNC4=O)c3ccccc3)nc2c1
O=C(CCCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1nc2ccccc2s1
O=C1NCN(c2ccccc2)C11CCN(CCCCc2c[nH]c3ccccc23)CC1
Clc1ccc2n(C3CCN(CCCCc4nc5ccccc5s4)CC3)c(=O)[nH]c2c1
Clc1ccc2n(C3CCN(CCCCC(=O)c4nc5ccccc5s4)CC3)c(=O)[nH]c2c1
Clc1ccc2n(C3CCN(CCCCc4nc5ccccc5o4)CC3)c(=O)[nH]c2c1
Fc1ccc(cc1)C(N1CCN(CCCCc2nc3ccccc3s2)CC1)c1ccc(F)cc1
Fc1ccc(cc1)C(N1CCN(CCCCC(=O)c2nc3ccccc3s2)CC1)c1ccc(F)cc1
OC1(CCN(CCCc2nc3ccccc3s2)CC1)c1ccc(Cl)cc1
OC1(CCN(CCCCc2nc3ccccc3s2)CC1)c1ccc(Cl)cc1
OC1(CCN(CCCCc2nc3ccccc3o2)CC1)c1ccc(Cl)cc1
OC1(CC2CCC(C1)N2CCCCc1nc2ccccc2s1)c1ccc(Cl)cc1
Oc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1
CC[C@@]12CCCN3CC[C@@]4([C@H]13)C(=Nc1ccccc41)C(C2)C(=O)OC |r,c:13|
CC[C@]12CCCN3CC[C@@]4([C@H]5CCCC[C@H]5N[C@H]4[C@H](C1)C([O-])=O)[C@H]23 |r|
CC[C@]12CCCN3CC[C@@]4([C@H]5CCCC[C@H]5N[C@H]4[C@H](C1)C(=O)OC)[C@H]23 |r|
CN(C)CCC1=C(Cc2ccc(F)cc2)c2ccccc2C1 |c:5|
CN(C)CCC1=C(Cc2cnccn2)c2ccccc2C1 |c:5|
CN(C)CCc1sc2ccccc2c1Cc1ccc(F)cc1
O=C1C(CCN2CCc3ccccc3C2)Cc2ccccc12
Clc1ccc2sc(CCCCN3CCc4c(Cl)cccc4C3)nc2c1
Clc1ccc(cc1)C(=O)CCCN1CCc2ccccc2CC1
Clc1ccc(cc1)C(=O)CCCN1CCCc2ccccc2C1
Clc1ccc2C(=O)C(CCN3CCc4ccccc4C3)Cc2c1
C(CN1CCc2ccccc2C1)Cc1nc2ccccc2s1
Clc1ccc2sc(CCCCN3CCc4ccccc4C3)nc2c1
Fc1ccc2C(=O)C(CCN3CCc4ccccc4C3)Cc2c1
Clc1ccc2sc(CCCCN3CCC4CCCCC4C3)nc2c1
C(CC1=Cc2ccccc2C1)N1CCc2ccccc2C1 |t:2|
C(CC1=Cc2ccccc2CC1)N1CCc2ccccc2C1 |t:2|
C(CN1CCc2ccccc2C1)Cc1nc2ccccc2[nH]1
Clc1cccc2CCN(CCCCc3nc4ccccc4s3)Cc12
O=C(CCCN1CCc2ccccc2C1)c1ccc2NC(=O)Cc2c1
CC1(C)CC(=O)N(CCCCN2Cc3ccccc3C2)C(=O)C1
COc1cc2CCN(CCCCc3nc4cc(Cl)ccc4s3)Cc2cc1OC
Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NC1CC1
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)OCCC |r|
O[C@@H]1[C@@H]2C[C@@H]2[C@H]([C@@H]1O)n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12 |r|
CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3NCc4cccc(c4)I)Cl)O)O
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@@H](C(C)C)C3CC3)nc(Cl)nc12 |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)OC |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(nc(Cl)nc12)N(C)C)C(O)=O |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12 |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)NCCNC(C)=O |r|
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(nc(nc12)C#Cc1ccc(Cl)s1)N(C)C)C(=O)NC |r|
Fc1ccc(cc1F)C#Cc1nc(NCc2cccc(Cl)c2)c2nc[nH]c2n1
O[C@@H]1[C@@H]2C[C@@H]2[C@H]([C@@H]1O)n1cnc2c(NCc3cccc(Cl)c3)nc(Cl)nc12 |r|
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(C3CC3)C3CC3)ncnc12 |r|
Nc1nc(Cl)nc2n(cnc12)[C@@H]1[C@H]2C[C@@]2(CO)[C@@H](O)[C@H]1O
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@@H](CC)C3CC3)nc(Cl)nc12 |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@H](C(C)C)C3CC3)nc(Cl)nc12 |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@H](C3CC3)C3CCC3)nc(Cl)nc12 |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(nc(Cl)nc12)N(C)C |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(nc(Cl)nc12)N(C)C)C(=O)NC |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(O)=O |r|
CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3NCc4cccc(c4)I)O)O
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(nc(Cl)nc12)N(C)C)C(=O)OCC |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@H](CC)C3CC3)nc(Cl)nc12 |r|
CNc1nc(Cl)nc2n(cnc12)[C@@H]1[C@H]2C[C@@]2(CO)[C@@H](O)[C@H]1O
Clc1cccc(CNc2nc(Cl)nc3[nH]cnc23)c1
Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(CC)CC)nc(Cl)nc12 |r|
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(N[C@@H](C3CC3)C3CCC3)nc(Cl)nc12 |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)NC |r|
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)NCCCNC(C)=O |r|
CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)OCC |r|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |r,c:21|
COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(c2)-c2cn(Cc3ccc(cc3)-c3ccc(Cn4cc(nn4)-c4cccc(c4)C(=O)NCCCCN4CCN(CC4)c4ccccc4OC)cc3)nn2)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-c2cn(Cc3ccc(cc3)-c3ccc(Cn4cc(nn4)-c4ccc(cc4)C(=O)NCCCCN4CCN(CC4)c4ccccc4OC)cc3)nn2)CC1
[H][C@@]12CCC[C@@]3([H])N(CCC)CC[C@@]([H])(c4cc5ccc(cc5nc4[C@@H]1CC)C(F)(F)F)[C@]23[H] |r|
[H][C@]12CCN(C)[C@]3([H])CCC[C@]([H])([C@@H](Cc4ccccc4)C(=O)C1)[C@@]23[H] |r|
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3ccccn3)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)C(=O)c3ccco3)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3ccccc3Cl)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(Cc4ccc5OCOc5c4)CC3)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3cccc(Cl)c3)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3ccc(Cl)cc3)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)ccc2[nH]1
CCOC(=O)c1cc2cc(OCCCN3CCN(CC3)c3ccc(OC)cc3)ccc2[nH]1
NCCn1cc(c2cccnc12)S(=O)(=O)c1ccccc1
CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1cccc(F)c1
CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1cccc(Cl)c1
NCCn1cc(c2cccnc12)S(=O)(=O)c1cccc(Cl)c1
CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1cccc2ccccc12
Cc1nc2c3CCNCCc3nc(Cc3ccccc3)n2n1
Cc1nnc2c3CCNCCc3nc(Cc3ccccc3)n12
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCCN1CCOCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCSCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCOCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCNCC1
CN1CCN(CCOc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2-c2ccnn2C)CC1
CC(=O)N1CCN(CCOc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2-c2ccnn2C)CC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCC(O)CC1
COC1CCN(CCOc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2-c2ccnn2C)CC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCC1
COC1CN(CCOc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2-c2ccnn2C)C1
CC1CCCCN1CCOc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1-c1ccnn1C
C[C@H]1CCC[C@@H](C)N1CCOc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1-c1ccnn1C |r|
Cn1nccc1-c1cc(NC(=O)Nc2ccccc2)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccccc2Cl)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2cccc(Cl)c2)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccccc2F)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2cccc(F)c2)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(F)cc2)ccc1OCCN1CCCCC1
Cc1ccc(NC(=O)Nc2ccc(OCCN3CCCCC3)c(c2)-c2ccnn2C)cc1
COc1cccc(NC(=O)Nc2ccc(OCCN3CCCCC3)c(c2)-c2ccnn2C)c1
COc1ccc(NC(=O)Nc2ccc(OCCN3CCCCC3)c(c2)-c2ccnn2C)cc1
Cn1nccc1-c1cc(NC(=O)Nc2cccc(c2)C(F)(F)F)ccc1OCCN1CCCCC1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)ccc1OCCN1CCCCC1
CC(=O)c1cccc(NC(=O)Nc2ccc(OCCN3CCCCC3)c(c2)-c2ccnn2C)c1
Cn1nccc1-c1cc(NC(=O)Nc2ccc(F)cc2F)ccc1OCCN1CCCCC1
Cc1ccc(F)c(NC(=O)Nc2ccc(OCCN3CCCCC3)c(c2)-c2ccnn2C)c1
Cn1nccc1-c1cc(NC(=O)Nc2cc(F)cc(F)c2)ccc1OCCN1CCCCC1
CCN(CC)CCOc1ccc(NC(=O)Nc2ccc(F)cc2)cc1-c1ccnn1C
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(F)cc2F)ccc1OCCN1CCCC1 |(28.77,-15.18,;28.73,-16.71,;29.96,-17.65,;29.45,-19.1,;27.91,-19.07,;26.98,-20.29,;27.47,-17.59,;26.02,-17.07,;24.69,-17.84,;23.36,-17.07,;22.03,-17.85,;20.69,-17.08,;20.69,-15.54,;19.36,-17.85,;18.03,-17.08,;18.02,-15.53,;16.69,-14.77,;15.36,-15.54,;14.02,-14.77,;15.35,-17.08,;16.69,-17.85,;16.69,-19.39,;23.35,-15.54,;24.68,-14.76,;26.02,-15.53,;27.35,-14.76,;27.35,-13.22,;28.68,-12.44,;30.02,-13.21,;30.19,-14.73,;31.69,-15.05,;32.46,-13.71,;31.42,-12.57,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2ccc(F)cc2F)ccc1OCCN1CCCC1 |(4.41,-24.98,;4.38,-26.52,;5.61,-27.45,;5.1,-28.91,;3.56,-28.87,;2.62,-30.1,;3.12,-27.4,;1.67,-26.88,;.34,-27.65,;-1,-26.88,;-2.33,-27.65,;-3.66,-26.88,;-3.67,-25.35,;-5,-27.66,;-6.33,-26.89,;-6.34,-25.34,;-7.67,-24.58,;-9,-25.35,;-10.33,-24.58,;-9,-26.89,;-7.67,-27.66,;-7.67,-29.2,;-1.01,-25.35,;.32,-24.57,;1.66,-25.34,;3,-24.56,;2.99,-23.03,;4.32,-22.25,;5.66,-23.02,;5.83,-24.54,;7.34,-24.85,;8.1,-23.52,;7.07,-22.38,)|
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(F)cc2)ccc1OCCN1CCCC1 |(28.29,-24.64,;28.25,-26.18,;29.48,-27.11,;28.97,-28.57,;27.43,-28.53,;26.5,-29.76,;26.99,-27.06,;25.54,-26.54,;24.21,-27.31,;22.88,-26.54,;21.55,-27.31,;20.21,-26.54,;20.21,-25,;18.88,-27.32,;17.55,-26.55,;16.21,-27.32,;14.87,-26.55,;14.88,-25.01,;13.54,-24.24,;16.21,-24.23,;17.54,-25,;22.87,-25.01,;24.2,-24.23,;25.54,-25,;26.87,-24.22,;26.87,-22.68,;28.2,-21.91,;29.54,-22.68,;29.71,-24.2,;31.22,-24.51,;31.98,-23.18,;30.95,-22.04,)|
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(O)cc2)ccc1OCCN1CCCC1 |(4.26,-34.54,;4.23,-36.08,;5.46,-37.01,;4.95,-38.46,;3.41,-38.43,;2.47,-39.65,;2.97,-36.95,;1.52,-36.43,;.19,-37.2,;-1.15,-36.43,;-2.48,-37.21,;-3.81,-36.44,;-3.81,-34.9,;-5.14,-37.21,;-6.48,-36.44,;-7.82,-37.21,;-9.15,-36.44,;-9.15,-34.9,;-10.48,-34.13,;-7.82,-34.13,;-6.49,-34.89,;-1.15,-34.9,;.17,-34.12,;1.52,-34.89,;2.85,-34.12,;2.84,-32.58,;4.18,-31.8,;5.51,-32.57,;5.68,-34.09,;7.19,-34.41,;7.96,-33.07,;6.92,-31.93,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2ccc(F)cc2F)ccc1OCCN1CCOCC1 |(27.36,-35.94,;27.33,-37.48,;28.56,-38.41,;28.05,-39.87,;26.51,-39.83,;25.57,-41.06,;26.07,-38.36,;24.62,-37.84,;23.29,-38.61,;21.95,-37.84,;20.62,-38.61,;19.29,-37.85,;19.29,-36.31,;17.96,-38.62,;16.62,-37.85,;16.61,-36.3,;15.28,-35.54,;13.95,-36.31,;12.62,-35.54,;13.95,-37.85,;15.28,-38.62,;15.28,-40.16,;21.95,-36.31,;23.27,-35.53,;24.62,-36.3,;25.95,-35.53,;25.94,-33.99,;27.28,-33.21,;28.61,-33.97,;29.37,-35.3,;30.89,-35.31,;31.67,-33.99,;30.9,-32.66,;29.37,-32.65,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2cc(F)cc(F)c2)ccc1OCCN1CCOCC1 |(4.32,-45.59,;4.29,-47.13,;5.52,-48.06,;5.01,-49.52,;3.47,-49.48,;2.54,-50.7,;3.03,-48,;1.58,-47.49,;.25,-48.26,;-1.08,-47.49,;-2.42,-48.26,;-3.75,-47.49,;-3.75,-45.95,;-5.08,-48.26,;-6.42,-47.49,;-7.75,-48.27,;-9.09,-47.5,;-10.42,-48.26,;-9.09,-45.95,;-7.76,-45.18,;-7.76,-43.64,;-6.42,-45.94,;-1.09,-45.95,;.24,-45.18,;1.58,-45.94,;2.91,-45.17,;2.91,-43.63,;4.24,-42.86,;5.57,-43.62,;6.33,-44.95,;7.86,-44.95,;8.63,-43.63,;7.87,-42.3,;6.33,-42.29,)|
Cn1nccc1-c1cc(NC(=O)Nc2cccc(F)c2)ccc1OCCN1CCOCC1
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCC1 |(5.77,3.8,;5.74,2.26,;6.97,1.33,;6.46,-.13,;4.92,-.09,;3.98,-1.31,;4.48,1.39,;3.03,1.9,;1.7,1.13,;.36,1.9,;-.97,1.13,;-2.3,1.9,;-2.31,3.44,;-3.64,1.13,;-4.97,1.89,;-6.31,1.12,;-7.64,1.89,;-7.64,3.44,;-8.97,4.21,;-6.31,4.21,;-4.98,3.44,;.36,3.44,;1.68,4.21,;3.03,3.44,;4.36,4.22,;4.35,5.76,;5.68,6.53,;7.02,5.77,;7.5,4.31,;9.04,4.32,;9.51,5.78,;8.26,6.68,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCC1 |(29.87,3.61,;29.84,2.07,;31.07,1.14,;30.56,-.32,;29.02,-.28,;28.09,-1.51,;28.58,1.19,;27.13,1.71,;25.8,.94,;24.47,1.71,;23.13,.94,;21.8,1.7,;21.8,3.24,;20.47,.93,;19.13,1.7,;17.8,.93,;16.46,1.7,;16.46,3.24,;15.13,4.01,;17.79,4.01,;19.13,3.25,;24.46,3.24,;25.79,4.02,;27.13,3.25,;28.46,4.02,;28.46,5.56,;29.79,6.34,;31.12,5.57,;31.6,4.11,;33.14,4.12,;33.61,5.59,;32.36,6.49,)|
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCC1
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCCC1 |(28.26,-6.71,;28.23,-8.25,;29.46,-9.19,;28.95,-10.64,;27.41,-10.6,;26.47,-11.83,;26.97,-9.13,;25.52,-8.61,;24.19,-9.38,;22.86,-8.61,;21.52,-9.38,;20.19,-8.62,;20.19,-7.08,;18.86,-9.39,;17.52,-8.62,;16.18,-9.39,;14.85,-8.62,;14.85,-7.08,;13.52,-6.31,;16.18,-6.31,;17.52,-7.07,;22.85,-7.08,;24.17,-6.3,;25.52,-7.07,;26.85,-6.3,;26.84,-4.76,;28.18,-3.98,;29.51,-4.75,;29.51,-6.29,;30.84,-7.05,;32.17,-6.28,;32.17,-4.74,;30.83,-3.97,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCCC1 |(4.23,-16.28,;4.2,-17.82,;5.43,-18.75,;4.92,-20.21,;3.38,-20.17,;2.44,-21.39,;2.94,-18.69,;1.49,-18.18,;.16,-18.95,;-1.18,-18.18,;-2.51,-18.95,;-3.84,-18.18,;-3.85,-16.64,;-5.18,-18.95,;-6.51,-18.19,;-7.85,-18.96,;-9.18,-18.19,;-9.18,-16.64,;-10.51,-15.87,;-7.85,-15.87,;-6.52,-16.64,;-1.18,-16.64,;.14,-15.87,;1.49,-16.64,;2.82,-15.86,;2.81,-14.32,;4.14,-13.55,;5.48,-14.31,;5.48,-15.85,;6.81,-16.62,;8.14,-15.85,;8.14,-14.31,;6.8,-13.53,)|
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCCCC1
Cn1ncc(Br)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCOCC1 |(4.32,-25.83,;4.29,-27.37,;5.52,-28.3,;5.01,-29.76,;3.47,-29.72,;2.54,-30.95,;3.03,-28.25,;1.58,-27.73,;.25,-28.5,;-1.08,-27.73,;-2.42,-28.5,;-3.75,-27.73,;-3.75,-26.19,;-5.08,-28.51,;-6.42,-27.74,;-7.75,-28.51,;-9.09,-27.74,;-9.09,-26.2,;-10.42,-25.43,;-7.76,-25.42,;-6.42,-26.19,;-1.09,-26.2,;.24,-25.42,;1.58,-26.19,;2.91,-25.41,;2.91,-23.87,;4.24,-23.1,;5.57,-23.87,;5.57,-25.4,;6.9,-26.17,;8.24,-25.4,;8.23,-23.86,;6.9,-23.08,)|
Cn1ncc(Cl)c1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCOCC1 |(29.57,-25.86,;29.54,-27.4,;30.77,-28.33,;30.26,-29.79,;28.72,-29.75,;27.78,-30.98,;28.28,-28.28,;26.83,-27.76,;25.5,-28.53,;24.16,-27.76,;22.83,-28.53,;21.5,-27.77,;21.49,-26.23,;20.16,-28.54,;18.83,-27.77,;17.49,-28.54,;16.16,-27.77,;16.16,-26.23,;14.83,-25.46,;17.49,-25.46,;18.82,-26.22,;24.16,-26.23,;25.48,-25.45,;26.83,-26.22,;28.16,-25.45,;28.15,-23.91,;29.48,-23.13,;30.82,-23.9,;30.82,-25.44,;32.15,-26.2,;33.48,-25.43,;33.48,-23.89,;32.14,-23.12,)|
Cn1nccc1-c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1OCCN1CCOCC1
CCN(CC)CCOc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1-c1ccnn1C
CCN(CC)CCCOc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1-c1ccnn1C
COc1ccccc1N1CCN(CCCn2c(C)cn3c2nc2n(C)c(=O)n(C)c(=O)c32)CC1
Cn1c2nc3n(CCCN4CCN(CC4)c4ccccc4)ccn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCn2ccn3c2nc2n(C)c(=O)n(C)c(=O)c32)CC1
Cn1c2nc3n(CCCN4CCN(CC4)c4cccc(Cl)c4)ccn3c2c(=O)n(C)c1=O
Cc1cn2c(nc3n(C)c(=O)n(C)c(=O)c23)n1CCCN1CCN(CC1)c1ccccc1
Cc1cn2c(nc3n(C)c(=O)n(C)c(=O)c23)n1CCCN1CCN(CC1)c1cccc(Cl)c1
Cn1c2nc3n(CCCN4CCN(CC4)c4ccccc4)c(cn3c2c(=O)n(C)c1=O)-c1ccccc1
COc1ccccc1N1CCN(CCCn2c(cn3c2nc2n(C)c(=O)n(C)c(=O)c32)-c2ccccc2)CC1
Cn1c2nc3n(CCCN4CCN(CC4)c4cccc(Cl)c4)c(cn3c2c(=O)n(C)c1=O)-c1ccccc1
Cn1c2nc3nc(NCCCN4CCN(CC4)c4ccccc4)c(Br)cn3c2c(=O)n(C)c1=O
C[C@@H]1CNCCN1c1cc(=O)n(C)c(COc2ccccc2C(F)(F)F)n1 |r|
C(c1ccccc1)c1cccc2N3CCNCC3CCc12
C(c1cccs1)c1cccc2N3CCNCC3CCc12
C(C1CCC1)c1cccc2N3CCNCC3CCc12
Fc1ccc2N3CCNCC3CCc2c1Cc1ccccc1
CC1(C)Cc2cccc(Cl)c2N2CCNCC12
CCCc1cccc2N3CCNCC3CCc12
C(c1ccc2OCOc2c1)c1cccc2N3CCNCC3CCc12
Clc1ccccc1CCOc1cncc(n1)N1CCNCC1
Clc1ccccc1OCCn1nc(ccc1=O)N1CCNCC1
C[C@@H]1CNCCN1c1ccc(=O)n(CCOc2ccccc2Cl)n1 |r|
C[C@@H](COc1ccccc1Cl)n1nc(ccc1=O)N1CCNCC1 |r|
FC(F)(F)c1ccccc1OCCn1nc(ccc1=O)N1CCNCC1
C[C@@H]1CNCCN1c1ccc(=O)n(CCOc2ccccc2C(F)(F)F)n1 |r|
N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:1.0,wD:4.4,(24.48,-16.8,;26.02,-16.8,;26.79,-15.47,;28.33,-15.47,;29.1,-16.8,;30.64,-16.8,;31.41,-18.14,;32.95,-18.14,;33.72,-16.8,;35.26,-16.8,;36.03,-18.14,;35.26,-19.47,;33.72,-19.47,;37.57,-18.14,;38.47,-16.89,;39.94,-17.37,;39.94,-18.91,;41.08,-19.94,;40.77,-21.44,;39.3,-21.92,;38.15,-20.88,;38.47,-19.38,;28.33,-18.14,;26.79,-18.14,)|
CS(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:8.8,wD:5.4,(36.84,-35.7,;35.3,-35.71,;33.84,-36.21,;35,-37.22,;34.52,-34.39,;32.98,-34.41,;32.2,-33.08,;30.66,-33.1,;29.9,-34.44,;28.37,-34.46,;27.58,-33.13,;26.04,-33.15,;25.26,-31.83,;23.72,-31.84,;22.96,-33.18,;23.74,-34.51,;25.29,-34.49,;21.43,-33.2,;20.53,-34.46,;19.07,-33.99,;19.05,-32.45,;17.9,-31.44,;18.2,-29.93,;19.66,-29.44,;20.81,-30.45,;20.51,-31.96,;30.68,-35.76,;32.23,-35.75,)|
Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:11.11,wD:14.15,(9.53,-25.15,;11.07,-25.16,;11.83,-26.49,;13.37,-26.5,;14.14,-25.16,;13.38,-23.83,;11.84,-23.82,;15.69,-25.17,;15.69,-26.71,;17.02,-25.94,;16.46,-23.84,;18,-23.84,;18.77,-22.51,;20.31,-22.51,;21.08,-23.85,;22.62,-23.85,;23.39,-22.53,;24.93,-22.52,;25.7,-21.2,;27.24,-21.2,;28.01,-22.53,;27.24,-23.86,;25.7,-23.86,;29.55,-22.54,;30.45,-23.79,;31.91,-23.32,;31.91,-21.78,;33.06,-20.75,;32.74,-19.24,;31.28,-18.76,;30.14,-19.79,;30.45,-21.29,;20.31,-25.18,;18.77,-25.18,)|
[O-][N+](=O)c1ccc2c(nsc2c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccco2)CC1 |r,wU:18.19,wD:21.26,(18.7,-13.51,;18.34,-15.04,;16.9,-15.51,;19.52,-16.08,;20.96,-15.56,;22.13,-16.64,;21.77,-18.12,;22.7,-19.36,;21.77,-20.59,;20.34,-20.13,;20.34,-18.59,;19.16,-17.56,;24.24,-19.36,;25.01,-20.69,;26.55,-20.69,;27.32,-19.36,;28.86,-19.36,;29.62,-20.69,;31.16,-20.69,;31.93,-19.36,;33.47,-19.36,;34.24,-20.69,;33.47,-22.02,;31.93,-22.02,;35.78,-20.69,;36.55,-22.02,;35.83,-23.41,;38.09,-21.97,;38.9,-20.64,;40.39,-21.05,;40.49,-22.59,;39.06,-23.15,;26.55,-18.02,;25.01,-18.02,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)N1CCOCC1 |r,wU:3.2,wD:6.6,(21,-21.12,;20.64,-19.63,;21.67,-18.49,;23.17,-18.8,;24.19,-17.67,;25.68,-17.98,;26.2,-19.42,;27.69,-19.78,;28.73,-18.6,;30.22,-18.96,;30.74,-20.4,;32.23,-20.71,;33.25,-19.57,;32.79,-18.14,;31.3,-17.77,;34.75,-19.89,;35.42,-21.32,;36.96,-21.17,;37.27,-19.63,;38.55,-18.85,;38.55,-17.31,;37.27,-16.54,;35.94,-17.31,;35.94,-18.85,;25.17,-20.61,;23.63,-20.3,;19.15,-19.21,;18.73,-17.72,;17.24,-17.36,;16.16,-18.44,;16.52,-19.94,;18.01,-20.35,)|
CCOC(=O)N1CCC(CCN2CCN(CC2)c2nsc3ccccc23)CC1
CC(C)N(C(C)C)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:10.9,wD:13.13,(10.89,-22.83,;10.18,-21.44,;8.69,-21.39,;11.05,-20.16,;10.33,-18.77,;8.79,-18.72,;11.2,-17.49,;12.59,-20.26,;13.26,-21.65,;13.36,-18.93,;14.9,-18.93,;15.66,-17.59,;17.2,-17.59,;17.98,-18.93,;19.52,-18.93,;20.28,-17.59,;21.82,-17.59,;22.59,-16.26,;24.13,-16.26,;24.9,-17.59,;24.13,-18.93,;22.59,-18.93,;26.44,-17.59,;27.31,-18.82,;28.8,-18.37,;28.8,-16.83,;29.87,-15.8,;29.56,-14.26,;28.13,-13.8,;27,-14.83,;27.31,-16.36,;17.2,-20.26,;15.66,-20.26,)|
CCCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:6.5,wD:9.9,(10.69,-26.4,;12.22,-26.5,;13.05,-25.22,;14.59,-25.27,;15.3,-26.65,;15.35,-23.94,;16.9,-23.94,;17.67,-22.61,;19.21,-22.61,;19.98,-23.94,;21.52,-23.94,;22.28,-22.61,;23.82,-22.61,;24.6,-23.94,;26.14,-23.94,;26.9,-22.61,;26.14,-21.27,;24.6,-21.27,;28.44,-22.61,;29.37,-23.89,;30.81,-23.37,;30.81,-21.83,;31.93,-20.81,;31.62,-19.32,;30.19,-18.85,;29.01,-19.88,;29.37,-21.37,;19.21,-25.27,;17.67,-25.27,)|
Clc1ccc2c(nsc2c1)N1CCN(C[C@H]2CC[C@H](CNC(=O)c3ccco3)CC2)CC1 |r,wU:18.20,wD:15.16,(61.66,-13.04,;60.17,-12.64,;59.14,-13.82,;57.6,-13.46,;57.14,-12.02,;55.75,-11.41,;55.91,-9.87,;57.39,-9.56,;58.17,-10.89,;59.71,-11.2,;54.42,-12.18,;53.09,-11.41,;51.75,-12.18,;51.75,-13.72,;50.42,-14.49,;49.09,-13.72,;49.09,-12.18,;47.75,-11.41,;46.41,-12.18,;45.08,-11.41,;43.75,-12.18,;42.42,-11.41,;42.31,-9.87,;41.14,-12.23,;41.09,-13.77,;39.6,-14.18,;38.78,-12.9,;39.75,-11.66,;46.41,-13.72,;47.75,-14.49,;53.09,-14.49,;54.42,-13.72,)|
FC(F)(F)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:7.6,wD:10.10,(11.43,-20.1,;11.8,-21.5,;10.77,-22.53,;10.39,-21.12,;13.28,-21.91,;13.7,-23.4,;14.31,-20.73,;15.81,-21.09,;16.83,-19.91,;18.37,-20.21,;18.83,-21.71,;20.33,-22.01,;21.35,-20.89,;22.89,-21.2,;23.35,-22.68,;24.85,-23,;25.87,-21.86,;25.41,-20.37,;23.92,-20.06,;27.41,-22.17,;28.03,-23.56,;29.57,-23.4,;29.88,-21.91,;31.22,-21.15,;31.22,-19.6,;29.88,-18.83,;28.55,-19.6,;28.55,-21.15,;17.81,-22.84,;16.32,-22.52,)|
O=C(NC[C@H]1CC[C@H](CN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccco1 |r,wU:4.3,wD:7.7,(14.45,-20.75,;14.55,-22.29,;15.89,-23.07,;17.22,-22.29,;18.55,-23.07,;19.89,-22.29,;21.22,-23.07,;21.22,-24.61,;22.55,-25.37,;23.89,-24.61,;23.89,-23.07,;25.22,-22.29,;26.56,-23.07,;26.56,-24.61,;25.22,-25.37,;27.89,-22.29,;28.05,-20.75,;29.53,-20.44,;30.3,-21.78,;31.84,-22.08,;32.3,-23.52,;31.28,-24.71,;29.74,-24.35,;29.28,-22.91,;19.89,-25.37,;18.55,-24.61,;13.27,-23.12,;13.23,-24.66,;11.74,-25.06,;10.92,-23.78,;11.89,-22.55,)|
O=S(=O)(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cccnc1 |r,wU:4.3,wD:7.7,(11.6,-23.29,;13.06,-23.79,;11.89,-24.79,;13.85,-22.47,;15.38,-22.49,;16.18,-21.18,;17.72,-21.2,;18.47,-22.55,;20,-22.57,;20.8,-21.26,;22.33,-21.29,;23.12,-19.96,;24.66,-19.99,;25.41,-21.33,;24.62,-22.66,;23.08,-22.63,;26.95,-21.37,;27.83,-22.63,;29.3,-22.18,;29.33,-20.64,;30.5,-19.63,;30.2,-18.12,;28.74,-17.61,;27.58,-18.63,;27.88,-20.14,;17.67,-23.87,;16.13,-23.85,;13.81,-25.13,;15.34,-25.16,;16.09,-26.5,;15.3,-27.83,;13.75,-27.8,;13.01,-26.45,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)C1CCCCC1 |r,wU:3.2,wD:6.6,(15.11,-24.25,;14.71,-22.76,;15.73,-21.63,;17.27,-21.94,;18.29,-20.81,;19.78,-21.12,;20.25,-22.56,;21.78,-22.92,;22.81,-21.74,;24.3,-22.1,;24.76,-23.53,;26.3,-23.84,;27.33,-22.71,;26.81,-21.28,;25.32,-20.92,;28.82,-23.02,;29.43,-24.46,;30.97,-24.31,;31.28,-22.76,;32.56,-22,;32.56,-20.45,;31.28,-19.69,;29.94,-20.45,;29.94,-22,;19.22,-23.74,;17.73,-23.43,;13.21,-22.35,;12.8,-20.86,;11.31,-20.51,;10.23,-21.59,;10.64,-23.07,;12.13,-23.48,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)C1CC1 |r,wU:3.2,wD:6.6,(14.82,-26.62,;14.05,-25.29,;14.82,-23.96,;16.36,-23.96,;17.13,-22.62,;18.67,-22.62,;19.44,-23.96,;20.98,-23.96,;21.75,-22.62,;23.29,-22.62,;24.05,-21.29,;25.59,-21.29,;26.37,-22.62,;25.59,-23.96,;24.05,-23.96,;27.9,-22.62,;28.8,-23.87,;30.27,-23.39,;30.27,-21.85,;31.41,-20.82,;31.09,-19.32,;29.63,-18.85,;28.48,-19.88,;28.8,-21.38,;18.67,-25.29,;17.13,-25.29,;12.51,-25.29,;11.17,-26.05,;11.17,-24.51,)|
CCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:5.4,wD:8.8,(11.36,-23.72,;12.08,-25.09,;13.63,-25.17,;14.35,-26.54,;14.39,-23.84,;15.92,-23.82,;16.73,-22.48,;18.25,-22.47,;19.02,-23.77,;20.55,-23.8,;21.36,-22.41,;22.89,-22.44,;23.66,-23.75,;25.22,-23.71,;25.99,-22.39,;25.18,-21.09,;23.64,-21.06,;27.51,-22.37,;28.43,-23.64,;29.9,-23.16,;29.87,-21.58,;30.95,-20.55,;30.62,-19.05,;29.21,-18.57,;28.06,-19.61,;28.39,-21.11,;18.27,-25.14,;16.74,-25.17,)|
O=C(N1CCC(CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccco1
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1cccnc1 |r,wU:6.6,wD:3.2,(28.69,-24.97,;29.08,-23.48,;28.06,-22.33,;26.55,-22.65,;25.52,-21.51,;24.02,-21.83,;23.54,-23.3,;22.03,-23.62,;21,-22.47,;19.49,-22.79,;19.01,-24.25,;17.51,-24.58,;16.48,-23.43,;16.96,-21.97,;18.46,-21.65,;14.97,-23.75,;14.34,-25.16,;12.82,-25,;12.49,-23.49,;11.16,-22.72,;11.16,-21.18,;12.49,-20.41,;13.83,-21.18,;13.83,-22.72,;24.57,-24.44,;26.07,-24.12,;30.57,-23.08,;30.97,-21.6,;32.46,-21.19,;33.55,-22.28,;33.15,-23.77,;31.66,-24.17,)|
CC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:4.3,wD:7.7,(11.77,-25.1,;13.32,-25.2,;14.03,-26.59,;14.08,-23.86,;15.63,-23.86,;16.4,-22.52,;17.94,-22.52,;18.71,-23.86,;20.25,-23.86,;21.02,-22.52,;22.56,-22.52,;23.33,-23.86,;24.87,-23.86,;25.64,-22.52,;24.87,-21.19,;23.33,-21.19,;27.19,-22.52,;28.11,-23.76,;29.55,-23.3,;29.55,-21.75,;30.73,-20.73,;30.37,-19.25,;28.93,-18.79,;27.8,-19.82,;28.11,-21.3,;17.94,-25.2,;16.4,-25.2,)|
CCCS(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:10.10,wD:7.6,(41.02,-21.07,;39.48,-21.06,;38.71,-22.4,;37.17,-22.39,;37.16,-23.93,;35.83,-23.16,;36.4,-21.06,;34.86,-21.06,;34.09,-19.73,;32.55,-19.74,;31.79,-21.07,;30.25,-21.07,;29.47,-19.74,;27.93,-19.74,;27.16,-18.41,;25.62,-18.41,;24.86,-19.74,;25.63,-21.07,;27.17,-21.07,;23.32,-19.74,;22.42,-20.99,;20.95,-20.51,;20.95,-18.97,;19.8,-17.94,;20.13,-16.44,;21.59,-15.96,;22.73,-16.99,;22.41,-18.49,;32.55,-22.4,;34.09,-22.4,)|
COCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:6.5,wD:9.9,(10.67,-26.47,;12.21,-26.52,;13.03,-25.23,;14.57,-25.33,;15.29,-26.66,;15.33,-24,;16.87,-24,;17.64,-22.66,;19.18,-22.66,;19.95,-23.99,;21.49,-23.98,;22.26,-22.65,;23.8,-22.65,;24.57,-23.98,;26.11,-23.98,;26.88,-22.64,;26.11,-21.31,;24.57,-21.31,;28.42,-22.64,;29.34,-23.87,;30.83,-23.4,;30.83,-21.86,;31.95,-20.84,;31.64,-19.3,;30.15,-18.84,;29.02,-19.87,;29.34,-21.36,;19.18,-25.32,;17.64,-25.33,)|
CN([C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)S(=O)(=O)c1cccs1 |r,wU:2.1,wD:5.5,(23.14,-23.94,;23.62,-22.48,;25.13,-22.16,;25.61,-20.7,;27.11,-20.38,;28.14,-21.52,;29.64,-21.2,;30.67,-22.35,;32.18,-22.03,;33.21,-23.17,;34.72,-22.85,;35.19,-21.39,;34.16,-20.24,;32.66,-20.56,;36.7,-21.06,;37.33,-19.66,;38.86,-19.82,;39.18,-21.32,;40.51,-22.1,;40.51,-23.63,;39.18,-24.41,;37.84,-23.63,;37.84,-22.1,;27.67,-22.98,;26.16,-23.31,;22.59,-21.33,;21.1,-20.94,;21.51,-22.42,;23.07,-19.87,;22.16,-18.63,;23.07,-17.38,;24.53,-17.86,;24.53,-19.4,)|
Nc1ccc2c(nsc2c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccco2)CC1 |r,wU:19.24,wD:16.17,(32.86,-20.47,;31.52,-21.25,;30.19,-20.47,;28.85,-21.25,;28.85,-22.79,;27.72,-23.81,;28.34,-25.2,;29.88,-25.05,;30.19,-23.56,;31.52,-22.79,;26.18,-23.51,;25.15,-24.64,;23.66,-24.33,;23.14,-22.84,;21.65,-22.54,;20.63,-23.66,;19.13,-23.35,;18.62,-21.86,;17.13,-21.56,;16.1,-22.69,;16.56,-24.17,;18.1,-24.49,;14.61,-22.37,;13.58,-23.56,;13.94,-25.05,;12.09,-23.15,;11.52,-21.71,;9.98,-21.76,;9.57,-23.25,;10.86,-24.12,;24.22,-21.71,;25.72,-22.02,)|
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1)c1ccccc1 |r,wU:3.2,wD:6.6,(14.96,-24.92,;14.59,-23.44,;15.62,-22.31,;17.11,-22.62,;18.13,-21.49,;19.62,-21.8,;20.13,-23.23,;21.61,-23.59,;22.64,-22.41,;24.13,-22.77,;24.64,-24.21,;26.12,-24.52,;27.15,-23.39,;26.69,-21.95,;25.15,-21.6,;28.64,-23.69,;29.3,-25.13,;30.79,-24.97,;31.15,-23.44,;32.48,-22.67,;32.48,-21.13,;31.15,-20.36,;29.82,-21.13,;29.82,-22.67,;19.1,-24.41,;17.57,-24.1,;13.11,-23.03,;12.7,-21.54,;11.21,-21.18,;10.14,-22.26,;10.49,-23.75,;11.98,-24.16,)|
CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:6.5,wD:9.9,(9.38,-16.11,;10.15,-17.44,;9.38,-18.77,;11.69,-17.44,;12.46,-18.77,;12.46,-16.11,;14,-16.11,;14.77,-14.78,;16.31,-14.78,;17.08,-16.11,;18.62,-16.11,;19.38,-14.78,;20.92,-14.78,;21.7,-13.44,;23.24,-13.44,;24,-14.78,;23.24,-16.11,;21.7,-16.11,;25.54,-14.78,;26.45,-16.02,;27.91,-15.54,;27.91,-14,;29.06,-12.97,;28.73,-11.46,;27.27,-10.99,;26.12,-12.02,;26.45,-13.53,;16.31,-17.44,;14.77,-17.44,)|
CCN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2nsc3ccccc23)CC1 |r,wU:7.6,wD:10.10,(10.36,-14.68,;9.54,-15.96,;10.26,-17.34,;9.38,-18.63,;11.75,-17.4,;12.46,-18.78,;12.51,-16.06,;14.05,-16.06,;14.82,-14.73,;16.36,-14.73,;17.13,-16.06,;18.67,-16.06,;19.44,-14.73,;20.98,-14.73,;21.75,-13.39,;23.29,-13.39,;24.05,-14.73,;23.29,-16.06,;21.75,-16.06,;25.59,-14.73,;26.52,-16.01,;28.01,-15.5,;28.01,-13.96,;29.07,-12.93,;28.77,-11.44,;27.34,-10.98,;26.21,-12.01,;26.52,-13.49,;16.36,-17.4,;14.82,-17.4,)|
CC(=O)c1ccc(OCc2ccc(Oc3cc(ccn3)-c3nn[nH]n3)cc2)c(C)c1O
CN(C)Cc1nc(-c2ccc(cc2)C(C)(C)C)n(n1)-c1cccc(O)c1
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2ccccn2)ccc1=O
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2nsc3ccccc23)ccc1=O
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Cc1ccc(cc1)-n1nc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1=O
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2cc(Cl)ccc2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(F)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2csc3ccccc23)ccc1=O
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccccc2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccccc2)CC1
Fc1ccc(c(F)c1)-n1nc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1=O
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2ccccc2)ccc1=O
Fc1ccc(F)c(c1)-n1nc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1=O
Cc1cccc(N2CCN(CCCOc3ccc(=O)n(n3)-c3ccc(Cl)c(Cl)c3)CC2)c1C
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2ncccn2)ccc1=O
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2ccccc2Cl)ccc1=O
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc1=O
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCC(CC2)c2c[nH]c3ccccc23)ccc1=O
Fc1ccc(cc1)C(=O)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Cc1c(C)c(=O)n(nc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)-c1ccc(Cl)c(Cl)c1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2nn(-c3ccc(Cl)c(Cl)c3)c(=O)c3CCCCc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2cc(Cl)cc(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2c(F)cccc2F)CC1 |(23.65,-6.56,;22.14,-6.23,;21.11,-7.37,;19.61,-7.04,;19.15,-5.58,;17.75,-4.96,;17.92,-3.43,;19.42,-3.11,;20.19,-4.45,;21.68,-4.77,;16.42,-5.72,;16.4,-7.26,;15.07,-8.02,;13.74,-7.24,;12.4,-8.01,;11.07,-7.23,;9.73,-8,;8.4,-7.22,;7.06,-7.99,;5.73,-7.21,;4.4,-7.99,;4.4,-9.53,;3.07,-10.3,;5.73,-10.29,;7.06,-9.53,;5.73,-11.83,;7.06,-12.6,;8.4,-11.82,;7.07,-14.14,;5.73,-14.91,;4.4,-14.14,;4.4,-12.6,;3.06,-11.83,;13.74,-5.71,;15.08,-4.94,)|
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2cc(F)cc(F)c2)CC1
NC(=O)c1ccc2occ(N3CCN(CCCOc4ccc(=O)n(n4)-c4ccc(Cl)c(Cl)c4)CC3)c2c1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2cccc(Cl)c2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc3ccccc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2cccc(Cl)c2)CC1
Fc1ccccc1N1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc(cc1)-n1nc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1=O
COc1ccccc1N1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
COc1ccc(cc1)N1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc(cc1)N1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCC(CC2)c2nc3ccccc3s2)ccc1=O
Fc1ccc2c(noc2c1)C1CCN(CCCCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2nn(-c3ccc(Cl)c(Cl)c3)c(=O)c3ccccc23)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)cc2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(F)c(F)c2)CC1
Clc1ccc(cc1Cl)-n1nc(OCCCN2CCN(Cc3ccccc3)CC2)ccc1=O
FC(F)(F)c1cccc(c1)N1CCN(CCCOc2ccc(=O)n(n2)-c2ccc(Cl)c(Cl)c2)CC1
Fc1ccc(F)c(CO[C@H]2CCc3ccc(nc23)N2CCNCC2)c1 |r|
C[C@@H]1CNCCN1c1ccc2CC[C@H](OCc3cc(F)ccc3F)c2n1 |r|
C1CCc2nc(ccc2C1)N1CCNCC1
Clc1ccccc1O[C@H]1CCCc2ccc(nc12)N1CCNCC1 |r|
Clc1ccccc1O[C@@H]1CCCc2ccc(nc12)N1CCNCC1 |r|
Clc1ccccc1OC1CCc2ccc(nc12)N1CCNCC1
Clc1ccccc1O[C@H]1CCc2ccc(nc12)N1CCNCC1 |r|
Clc1ccccc1O[C@@H]1CCc2ccc(nc12)N1CCNCC1 |r|
Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CC1)c1cccc2cccnc12
COc1ccccc1N1CCN(CCCN(CC2CC2)S(=O)(=O)c2cccc3cccnc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2cccc3cccnc23)CC1
Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2cccc3cccnc23)CC1
CC(CCN1CCN(CC1)c1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1
COc1ccccc1N1CCN(CCC(C)NS(=O)(=O)c2ccc3ccccc3c2)CC1
CC(CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)NS(=O)(=O)c1ccc2ccccc2c1
CC(CCN1CCN(CC1)c1ccc(F)cc1)NS(=O)(=O)c1ccc2ccccc2c1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1)c1cccc2ccccc12
FC(F)(F)c1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1
Fc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1OC)CC1CCCCC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1cccc(c1)C(F)(F)F)CC1CCCCC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccc(F)cc1)CC1CCCCC1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1)c1ccc2ccccc2c1
COc1ccccc1N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
Fc1ccc(cc1)N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CCCCC1)c1cccc2cccnc12
COc1ccccc1N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2cccc3cccnc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2cccc3cccnc23)CC1
Fc1ccc(cc1)N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2cccc3cccnc23)CC1
Clc1ccc(cc1Cl)N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2cccc3cccnc23)CC1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CC1)c1cccc2ccccc12
FC(F)(F)c1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1
Fc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1OC)CC1CC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1cccc(c1)C(F)(F)F)CC1CC1
COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccc(F)cc1)CC1CC1
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CC1)c1ccc2ccccc2c1
COc1ccccc1N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
Cn1ncc(Br)c1-c1cccc(NC(=O)Nc2ccc(Cl)cc2)c1
COc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1-c1c(Br)cnn1C |(3.23,5.95,;3.24,4.41,;1.91,3.64,;.56,4.41,;-.76,3.63,;-.76,2.1,;-2.09,1.32,;-3.42,2.09,;-3.43,3.63,;-4.76,1.32,;-6.09,2.09,;-7.43,1.32,;-8.76,2.09,;-8.76,3.63,;-10.09,4.4,;-7.43,4.4,;-6.1,3.64,;.58,1.33,;1.91,2.1,;3.24,1.33,;3.4,-.2,;2.25,-1.22,;4.9,-.51,;5.67,.82,;4.64,1.96,;4.95,3.47,)|
Cn1ncc(Br)c1-c1cccc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)c1
Cc1cccc2N3CCNCC3NC(=O)c12
Cc1ccc2N3CCNCC3NC(=O)c2c1
Cc1ccc2C(=O)NC3CNCCN3c2c1
Cc1cccc2C(=O)NC3CNCCN3c12
Clc1cccc2N3CCNCC3NC(=O)c12
O=C1NC2CNCCN2c2ccccc12
Clc1ccc2N3CCNCC3NC(=O)c2c1
FC(F)(F)c1cccc2N3CCNCC3NC(=O)c12
Clc1cccc2C(=O)NC3CNCCN3c12
O=C1NC2CCNCCN2c2ccccc12
Cc1cccc2N3CCNCCC3NC(=O)c12
Clc1cccc2N3CCNCCC3NC(=O)c12
Cc1ccc2C(=O)NC3CCNCCN3c2c1
Clc1cccc2N3CCCNCC3NC(=O)c12
COc1ccc2c3C(CN)c4ccccc4Cc3ccc2c1
C(Cc1ccccc1)NCC1c2ccccc2Cc2ccccc12
C(CNCC1c2ccccc2Cc2ccccc12)Cc1ccccc1
C(CCc1ccccc1)CNCC1c2ccccc2Cc2ccccc12
O=C(N1CCN(CC1)C(=O)c1ccc2cc[nH]c2c1)c1ccc(cc1)-c1ccccc1
COc1cccc(c1)-c1ccc(cc1)C(=O)N1CCN([C@@H](C)C1)C(=O)c1ccc2cc[nH]c2c1 |r|
COc1cccc(c1)-c1ccc(cc1)C(=O)N1CCN([C@H](C)C1)C(=O)c1ccc2cc[nH]c2c1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1cccc(OC(F)(F)F)c1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1cccc(c1)C(F)(F)F |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1cccc(F)c1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccccc1 |r|
COc1ccccc1-c1ccc(cc1)C(=O)N1CCN([C@@H](C)C1)C(=O)c1ccc2cc[nH]c2c1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccccc1F |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccccc1Cl |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccccc1C(F)(F)F |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccccc1C |r|
COc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCN([C@@H](C)C1)C(=O)c1ccc2cc[nH]c2c1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(OC(F)(F)F)cc1 |r|
C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r|
COc1ccc(CCCN2CCC(CCC(=O)c3cc(Cl)c(N)c4OCCOc34)CC2)cc1OC
Cn1cc(C(=O)C(=O)N[C@H]2CN3CCC2CC3)c2ccccc12 |wU:9.8,(10.51,-11.56,;10.03,-10.1,;10.93,-8.84,;10,-7.6,;10.47,-6.14,;9.44,-4.99,;11.98,-5.81,;13.01,-6.95,;12.45,-4.34,;13.94,-4.02,;14.41,-2.55,;15.91,-2.22,;16.95,-3.36,;16.47,-4.83,;14.97,-5.16,;16.06,-4.06,;14.82,-3.32,;8.55,-8.09,;7.21,-7.32,;5.88,-8.09,;5.88,-9.63,;7.21,-10.4,;8.56,-9.63,)|
Cn1cc(C(=O)C(=O)N[C@@H]2CN3CCC2CC3)c2ccccc12 |wD:9.8,(9.31,-11.63,;8.84,-10.16,;9.73,-8.91,;8.82,-7.65,;9.29,-6.2,;8.25,-5.05,;10.79,-5.85,;11.84,-7,;11.27,-4.4,;12.77,-4.05,;13.23,-2.6,;14.74,-2.27,;15.78,-3.41,;15.3,-4.87,;13.8,-5.2,;14.89,-4.1,;13.64,-3.35,;7.35,-8.14,;6.02,-7.37,;4.68,-8.16,;4.68,-9.7,;6.02,-10.47,;7.37,-9.69,)|
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1)-c1ccccc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
CCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
CC(C)Cn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
Cc1c(cc(-c2ccccc2)n1N1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
Cc1c(cc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
Cc1c(cc(-c2ccccc2)n1Cc1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
Cc1c(cc(-c2ccccc2)n1CC1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C)-c1ccccc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CC(C)Cn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(-c2ccccc2)n1N1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(-c2ccccc2)n1Cc1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(-c2ccccc2)n1CC1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccccc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CC(C)Cn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1N1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1Cc1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1CC1CCCCC1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1[nH]c(cc1C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccccc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1[nH]c(cc1C(=O)NCCCCN1CCN(CC1)c1cccc(C)c1C)-c1ccccc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCCN1CCN(CC1)c1cccc(C)c1C
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCCN1CCN(CC1)c1cccc(C)c1C
Fc1ccc2c(c[nH]c2c1)C1=CCN(CCN2c3cccc4CCCN(c34)S2(=O)=O)CC1 |t:12|
Fc1ccc(OC[C@@H]2CNCCO2)c2CCCc12 |r|
CCc1c(C)[nH]c2CCC(CCN3CCOCC3)C(=O)c12
CCc1c(C)[nH]c2CCC(CCN3CCN(CC3)c3ccccc3OC)C(=O)c12
CN1CCC(CC1)c1c[nH]c2ccc(cc12)-n1cnnc1
CN(C)CCc1c[nH]c2ccc(cc12)-n1cnnc1
CN(C)CCc1c[nH]c2ccc(Cn3cncn3)cc12
CN(C)CCc1c[nH]c2ccc(cc12)-n1cncn1
COc1cc(Cl)c(Cl)cc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccccc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)S(N)(=O)=O)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C#N)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1cccc(Cl)c1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(C)cc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1ccc(cc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O)-c1ccccc1
COc1ccccc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1ccc(cc1)S(=O)(=O)Nc1cc(C(=O)CCCCN2CCC3(CC2)NC(=O)NC3=O)c(OC)cc1OC
COc1ccc(Cl)cc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C(C)=O)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccccc1Cl)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(Cl)ccc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC2CCC(C)(C)CC2)c(F)cc1CNC(=O)[C@@H]1CCCN1 |r|
CC1(C)CCC(CC1)Oc1cc(F)c(CNC(=O)[C@@H]2CCCN2)cc1F |r|
C[C@H]1CC[C@H](CC1)Oc1c(F)cc(CNC(=O)[C@@H]2CCCN2)cc1F |r,wU:17.17,wD:4.7,1.0,(-10.94,-38.56,;-9.61,-39.33,;-9.61,-40.88,;-8.28,-41.66,;-6.95,-40.88,;-6.94,-39.34,;-8.27,-38.57,;-5.62,-41.65,;-4.28,-40.88,;-4.28,-39.34,;-5.61,-38.57,;-2.95,-38.57,;-1.62,-39.33,;-.29,-38.56,;1.05,-39.32,;2.38,-38.55,;2.38,-37.01,;3.72,-39.31,;3.68,-40.85,;5.13,-41.37,;6.07,-40.15,;5.2,-38.88,;-1.61,-40.88,;-2.95,-41.66,;-2.95,-43.2,)|
COc1cc(OCC2CCCCC2)c(F)cc1CNC(=O)[C@@H]1CCCN1 |r|
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(F)cc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C(C)C)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O)-c1ccccc1
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(NC(C)=O)cc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(Cl)cc1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
COc1ccc(OC)c(c1)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]1CCN(CCC2CCN(CC2)C(=O)c2ccccc2)C1 |r|
Fc1ccccc1C(=O)N1CCC(CCN2CC[C@H](C2)NC(=O)CNC(=O)c2cccc(c2)C(F)(F)F)CC1 |r|
Fc1ccc(F)c(c1)C(=O)N1CCC(CCN2CC[C@H](C2)NC(=O)CNC(=O)c2cccc(c2)C(F)(F)F)CC1 |r|
FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]1CCN(CCC2CCN(CC2)C(=O)c2ccccc2Cl)C1 |r|
FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]1CCN(CCN2CCN(CC2)C(=O)c2ccccc2)C1 |r|
FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]1CCN(CCN2CCN(CC2)C(=O)c2ccccc2Cl)C1 |r|
Fc1ccccc1C(=O)N1CCN(CCN2CC[C@H](C2)NC(=O)CNC(=O)c2cccc(c2)C(F)(F)F)CC1 |r|
Fc1ccc(F)c(c1)C(=O)N1CCN(CCN2CC[C@H](C2)NC(=O)CNC(=O)c2cccc(c2)C(F)(F)F)CC1 |r|
COc1ccccc1N1CCN(CCCN2C(=O)NC3(CCc4ccccc34)C2=O)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)NC3(CCc4ccccc34)C2=O)CC1
O=C1NC2(CCCc3ccccc23)C(=O)N1CCCN1CCN(CC1)c1ccccc1
COc1ccccc1N1CCN(CCCN2C(=O)NC3(CCCc4ccccc34)C2=O)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)NC3(CCCc4ccccc34)C2=O)CC1
CC1(NC(=O)N(CCCN2CCN(CC2)c2ccccc2)C1=O)c1ccccc1
COc1ccccc1N1CCN(CCCN2C(=O)NC(C)(C2=O)c2ccccc2)CC1
CC1(NC(=O)N(CCCN2CCN(CC2)c2cccc(Cl)c2)C1=O)c1ccccc1
O=C1NC(C2CC2)(C(=O)N1CCCN1CCN(CC1)c1ccccc1)c1ccccc1
COc1ccccc1N1CCN(CCCN2C(=O)NC(C3CC3)(C2=O)c2ccccc2)CC1
Clc1cccc(c1)N1CCN(CCCN2C(=O)NC(C3CC3)(C2=O)c2ccccc2)CC1
O=C1NC2(CCc3ccccc23)C(=O)N1CCCN1CCN(CC1)c1ccccc1
CCc1c(C)[nH]c2CC(CN3CCN(CCCC(=O)c4ccc(F)cc4)CC3)CC(=O)c12
CCc1c(C)[nH]c2CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)CC(=O)c12
CCc1c(C)[nH]c2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c12
CCc1c(C)[nH]c2CC(CN3CCN(CC3)c3ccccc3OC)CC(=O)c12
COc1ccc(cc1)N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:15.15|
COc1ccccc1N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:15.15|
COCCN1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:11.10|
O=C(N1CCN(CCCN=C(NC#N)c2ccncc2)CC1)c1ccco1 |w:9.8|
N#CNC(=NCCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccncc1 |w:4.4|
FC(F)(F)c1cccc(c1)N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:17.17|
Clc1cccc(c1)N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:14.14|
Clc1ccccc1N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:14.14|
Cc1cccc(N2CCN(CCCN=C(NC#N)c3ccncc3)CC2)c1C |w:13.12|
N#CNC(=NCCCN1CCN(CC1)c1ccccc1C#N)c1ccncc1 |w:4.4|
CCOc1ccccc1N1CCN(CCCN=C(NC#N)c2ccncc2)CC1 |w:16.16|
Clc1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)nn1
Oc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1
CCN(CC)CC1Cc2[nH]c3ccccc3c2C(=O)C1
COc1ccccc1N1CCN(CC2Cc3[nH]c4ccccc4c3C(=O)C2)CC1
CCN(CC)CC1Cc2c(C(=O)C1)c1ccccc1n2C
Fc1ccc(cc1)C(=O)C1CCN(CC2Cc3[nH]c4ccccc4c3C(=O)C2)CC1
O=C1CC(CN2CCOCC2)Cc2[nH]c3ccccc3c12
Fc1ccc2c(noc2c1)C1CCN(CC2Cc3[nH]c4ccccc4c3C(=O)C2)CC1
CC(C)(C)c1ccc(SCCc2cnc[nH]2)cc1
Cn1nccc1-c1cc(NC(=O)c2ccc(cc2)C(F)(F)F)ccc1OCCN1CCCC1
Cn1nccc1-c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1OCCN1CCCC1
Cn1nccc1-c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1OCCN1CCC(F)(F)C1
Cn1nccc1-c1cc(NC(=O)c2ccc(F)cc2F)ccc1OCCN1CCOCC1
Cn1nccc1-c1cc(NC(=O)c2cccc(F)c2)ccc1OCCN1CCOCC1
Cn1nccc1-c1cc(NC(=O)c2ccc(F)cc2)ccc1OCCN1CCOCC1
Cn1ncc(Cl)c1-c1cc(NC(=O)c2cccc(F)c2)ccc1OCCN1CCOCC1 |(-5.98,-34.34,;-5.66,-35.84,;-6.69,-36.99,;-5.92,-38.32,;-4.41,-38,;-3.26,-39.03,;-4.25,-36.47,;-2.92,-35.7,;-1.59,-36.48,;-.25,-35.7,;1.09,-36.47,;2.42,-35.7,;2.42,-34.16,;3.75,-36.47,;3.75,-38,;5.08,-38.77,;6.41,-38,;6.41,-36.45,;7.74,-35.67,;5.07,-35.69,;-.26,-34.15,;-1.59,-33.39,;-2.92,-34.16,;-4.25,-33.39,;-4.25,-31.85,;-5.59,-31.08,;-5.59,-29.54,;-4.25,-28.77,;-4.25,-27.24,;-5.58,-26.46,;-6.92,-27.23,;-6.92,-28.77,)|
Cn1nccc1-c1cc(NC(=O)c2ccc(cc2)C(F)(F)F)ccc1OCCN1CCOCC1
Cn1nccc1-c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1OCCN1CCOCC1
Cn1nccc1-c1cc(NC(=O)c2ccc(F)c(F)c2)ccc1OCCN1CCOCC1
COc1cccc(c1)C(=O)Nc1ccc(OCCN2CCOCC2)c(c1)-c1ccnn1C
Cn1nccc1-c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1OCCN1CCNC(=O)C1
Cn1ncc(Cl)c1-c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1OCCN1CCNC(=O)C1 |(-5.14,-22.2,;-4.83,-23.71,;-5.86,-24.85,;-5.09,-26.19,;-3.58,-25.86,;-2.43,-26.89,;-3.42,-24.34,;-2.09,-23.57,;-.75,-24.34,;.58,-23.57,;1.92,-24.34,;3.25,-23.57,;3.25,-22.03,;4.58,-24.33,;4.58,-25.87,;5.91,-26.64,;7.25,-25.87,;7.24,-24.32,;5.9,-23.56,;8.57,-23.54,;9.91,-24.3,;8.56,-22,;9.89,-22.76,;.58,-22.02,;-.76,-21.26,;-2.09,-22.03,;-3.42,-21.26,;-3.42,-19.72,;-4.76,-18.95,;-4.76,-17.41,;-3.42,-16.64,;-3.42,-15.1,;-4.75,-14.33,;-6.09,-15.09,;-7.42,-14.32,;-6.09,-16.64,)|
CC(=O)N1CCN(CCOc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2-c2ccnn2C)CC1
CC(=O)N1CCN(CCOc2ccc(NC(=O)c3cccc(F)c3)cc2-c2ccnn2C)CC1
CC(=O)N1CCN(CCOc2ccc(NC(=O)c3cccc(F)c3)cc2-c2c(Cl)cnn2C)CC1 |(-8.55,-30.04,;-9.88,-30.81,;-11.22,-30.03,;-9.89,-32.35,;-8.56,-33.12,;-8.56,-34.66,;-9.9,-35.43,;-9.9,-36.97,;-8.56,-37.74,;-8.56,-39.28,;-7.23,-40.05,;-5.9,-39.28,;-4.56,-40.04,;-4.56,-41.59,;-3.22,-42.36,;-1.89,-41.59,;-1.89,-40.05,;-.56,-42.36,;-.56,-43.89,;.77,-44.66,;2.1,-43.89,;2.1,-42.34,;3.43,-41.56,;.76,-41.58,;-5.9,-42.36,;-7.23,-41.59,;-8.56,-42.36,;-8.72,-43.89,;-7.57,-44.91,;-10.23,-44.21,;-11,-42.88,;-9.97,-41.73,;-10.28,-40.22,;-11.25,-34.66,;-11.24,-33.12,)|
COc1cccc(c1)C(=O)Nc1ccc(OCCN2CCN(CC2)C(C)=O)c(c1)-c1ccnn1C
COc1cccc(c1)C(=O)Nc1ccc(OCCN2CCN(CC2)C(N)=O)c(c1)-c1ccnn1C
COc1cccc(c1)C(=O)Nc1ccc(OCCN2CCN(CC2)S(C)(=O)=O)c(c1)-c1ccnn1C
COc1cccc(c1)C(=O)Nc1ccc(OCCNCCO)c(c1)-c1ccnn1C
COc1cccc(c1)C(=O)Nc1ccc(OCCN)c(c1)-c1ccnn1C
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c2cccc3Cl)cn1
Cc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)c(Cl)c3)c2cc1C(F)(F)F
Cc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)c(Cl)c3)c2cc1Cl
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c2ccc(Cl)c3Cl)cn1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nn3)c2cc1C(F)(F)F
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(Br)ccc23)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(Br)c(cc23)C(F)(F)F)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(Cl)c(Cl)cc23)cn1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1F
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c2cccc3Br)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c2cccc3C(F)(F)F)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(I)ccc23)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(Cl)ccc23)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c4CCOc4c(cc23)C(F)(F)F)cn1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4Cl)nc3)c2cc1Cl
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3ccc(Cl)cc23)cn1
Cc1ccncc1Oc1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3ccc(cc23)C(F)(F)F)cn1
CCCc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cn1
CCc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1C(F)(F)F
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(F)c(Cl)cc23)cn1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cncnc4C)nc3)c2cc1C(F)(F)F
CC(C)c1ncccc1Oc1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cn1
Cc1cc2N(CCc2cc1Cl)C(=O)Nc1ccc(Oc2cccnc2C)nc1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1Br
CSc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nc3)c2cc1C(F)(F)F
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3ccccc23)cn1
Cc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)nc3)c2cc1Cl
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cccnc4C)nn3)c2cc1Cl
Cc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)cn3)c2cc1C(F)(F)F
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(F)ccc23)cn1
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3c2cc(Cl)c(C)c3Cl)cn1
COc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)cc3C)c2cc1C(F)(F)F
CCc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cn1
Cc1ccc2N(CCc2c1Br)C(=O)Nc1ccc(Oc2cccnc2C)nc1
Cc1cc2CCN(C(=O)Nc3ccc(Oc4cnccc4Cl)nc3)c2cc1Cl
Cc1ncccc1Oc1ccc(NC(=O)N2CCc3cc(ccc23)C(F)(F)F)cn1
Cc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)c(C)c3)c2cc1Cl
Clc1ccc2N(CCc2c1)C(=O)Nc1ccc(OCc2ccccn2)nc1
Cc1cccnc1COc1ccc(NC(=O)N2CCc3cc(C)c(cc23)C(F)(F)F)cn1
Cc1cc2CCN(C(=O)Nc3ccc(OCc4ccccn4)cc3)c2cc1C(F)(F)F
Clc1cccc2N(CCc12)C(=O)Nc1ccc(OCc2ccccn2)nc1
Cc1cc2CCN(C(=O)Nc3ccc(OCc4ccccn4)nn3)c2cc1C(F)(F)F
Cc1cc2CCN(C(=O)Nc3ccc(OCc4cccnc4)nc3)c2cc1Cl
Cc1cc2CCN(C(=O)Nc3ccc(OCCc4ccccn4)nc3)c2cc1C(F)(F)F
FC(F)(F)c1ccc2CCN(C(=O)Nc3ccc(OCc4ccccn4)nc3)c2c1
FC(F)(F)c1ccc2N(CCc2c1)C(=O)Nc1ccc(OCc2ccccn2)nc1
Cc1cc2CCN(C(=O)Nc3ccc(OCc4ccncc4)nc3)c2cc1Cl
Brc1ccc2N(CCc2c1)C(=O)Nc1ccc(OCc2ccccn2)nc1
Cc1cc2CCN(C(=O)Nc3ccc(CCc4ccccn4)nc3)c2cc1C(F)(F)F
Cc1cc(NC(=O)N2CCc3cc(C)c(cc23)C(F)(F)F)cnc1OCc1ccccn1
Cc1cc2CCN(C(=O)Nc3ccc(OCc4cncn4C)nc3)c2cc1C(F)(F)F
Cc1cccc(COc2ccc(NC(=O)N3CCc4cc(C)c(cc34)C(F)(F)F)cn2)n1
Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccn4C)nc3)c2cc1Cl
Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccs4)nc3)c2cc1Cl
Cc1cc2CCN(C(=O)Nc3ccc(OCc4cnccn4)nc3)c2cc1C(F)(F)F
Cc1cc2CCN(C(=O)Nc3ccc(OCc4ccccn4)nc3)c2cc1C(F)(F)F
Cc1cc2CCN(C(=O)Nc3ccc(COc4ccccn4)nc3)c2cc1C(F)(F)F
Cc1cc2CCN(C(=O)Nc3ccc(OCc4ccccn4)nc3)c2cc1Cl
Fc1ccc(CCC2CCN(CC2)S(=O)(=O)c2cccc3cccnc23)c(F)c1
Fc1ccc(\C=C\c2ccc(cc2)S(=O)(=O)c2ccccc2)c(F)c1
Fc1ccc(CCc2ccc(cc2)S(=O)(=O)c2ccccc2)c(F)c1
NC(=O)c1ccccc1S(=O)(=O)c1ccc(\C=C\c2ccc(F)cc2F)cc1
NC(=O)c1cccc(c1)S(=O)(=O)c1ccc(\C=C\c2ccc(F)cc2F)cc1
NC(=O)c1ccc(cc1)S(=O)(=O)c1ccc(\C=C\c2ccc(F)cc2F)cc1
CC(O)c1ccccc1S(=O)(=O)c1ccc(\C=C\c2ccc(F)cc2)cc1
C[C@H](O)c1ccccc1S(=O)(=O)c1ccc(\C=C\c2ccc(F)cc2)cc1 |r|
CN(CC[C@@H](Oc1ccc(cc1)C(F)(F)F)c1ccccc1)CC([O-])=O
Oc1ccc2[nH]cc(C3CCN(CCCCCNC(=O)\C=C\c4ccc(Cl)c(Cl)c4)CC3)c2c1
Oc1ccc2[nH]cc([C@H]3C[C@@H]4CC[C@H](C3)N4C[C@H]3CC[C@H](CC3)NC(=O)\C=C\c3ccc(Cl)c(Cl)c3)c2c1 |wU:10.16,8.7,20.25,17.18,13.15,THB:16:15:8.14.9:11.12,(1.43,-5.64,;2.76,-6.41,;2.76,-7.94,;4.09,-8.72,;5.49,-7.93,;6.98,-8.35,;7.82,-7.06,;6.89,-5.85,;7.28,-4.38,;6.21,-3.29,;6.63,-1.8,;7.03,-3.29,;8.1,-3.61,;9.19,-2.54,;8.77,-4.01,;8.12,-1.42,;7.05,-.12,;7.66,1.49,;6.75,2.73,;7.35,4.13,;8.89,4.31,;9.82,3.08,;9.19,1.66,;9.5,5.75,;10.97,6.18,;11.33,7.68,;12.09,5.13,;13.55,5.54,;14.67,4.49,;14.01,3.1,;14.88,1.83,;16.42,1.95,;17.28,.67,;17.1,3.35,;18.64,3.44,;16.24,4.61,;5.44,-6.39,;4.09,-5.62,)|
CCc1c(sc2ccc(Cl)cc12)S(=O)(=O)Nc1ccc2nccc(N3CCNCC3)c2c1
Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)Nc1ccc2nccc(N3CCNCC3)c2c1
O=S(=O)(Nc1ccc2nccc(N3CCNCC3)c2c1)c1ccc(cc1)-c1ccccc1
Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)Nc1ccc2nc(C)cc(N3CCNCC3)c2c1
CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc2nccc(N3CCNCC3)c2c1
C[C@H]1CN(CCN1)c1ccnc2ccc(NS(=O)(=O)c3sc4ccc(Cl)cc4c3C)cc12
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)Nc1ccc2nccc(N3CCNCC3)c2c1
CN1CCN(CC1)c1ccnc2ccc(NS(=O)(=O)c3sc4ccc(Cl)cc4c3C)cc12
Clc1cccc2cc(ccc12)S(=O)(=O)Nc1ccc2nccc(N3CCNCC3)c2c1
CS(=O)(=O)Oc1ccc2CN(CC[C@H]3CC[C@@H](CC3)NC(=O)\C=C\c3ccc(F)cc3)Cc2c1 |wU:16.19,wD:13.12,(-.65,-16.53,;-.63,-15,;-2.01,-14.31,;-.33,-13.47,;.91,-14.92,;2.24,-14.15,;2.24,-12.6,;3.57,-11.83,;4.9,-12.58,;6.37,-12.09,;7.29,-13.35,;8.62,-12.58,;9.96,-13.35,;11.29,-12.56,;12.62,-13.33,;13.94,-12.56,;13.94,-11.02,;12.62,-10.25,;11.29,-11.02,;15.28,-10.27,;16.61,-11.04,;16.61,-12.58,;17.94,-10.27,;19.27,-11.04,;20.6,-10.27,;21.93,-11.04,;23.27,-10.27,;23.27,-8.73,;24.36,-7.64,;21.93,-7.96,;20.6,-8.73,;6.39,-14.61,;4.91,-14.14,;3.58,-14.92,)|
COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN2CCCCC2C1
COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN(C)CC1
COc1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)cc1N1CCN2CCC[C@H]2C1
[H][C@]12CCCN1CCN(C2)c1cc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)ccc1OC
C(CCCN1CCN(CC1)c1ccccc1)CCN1CCN(CC1)c1ccccc1
Cc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2cccc(C)c2)CC1
COc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2cccc(OC)c2)CC1
Clc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2cccc(Cl)c2)CC1
C(CCCN1CCN(CC1)c1ccccn1)CCN1CCN(CC1)c1ccccn1
C(CCCN1CCN(CC1)c1ccccn1)CCN1CCN(CC1)c1ccccc1
Cc1cccc(n1)N1CCN(CCCCCCN2CCN(CC2)c2ccccc2)CC1
Cc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2ccccc2)CC1
C(CCCN1CCN(CC1)c1ccnc2ccccc12)CCN1CCN(CC1)c1ccccc1
Cc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2ccccn2)CC1
Cc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2cccc(C)n2)CC1
COc1cccc(c1)N1CCN(CCCCCCN2CCN(CC2)c2cccc(Cl)c2)CC1
Clc1ccc(OC2CCN(CC[C@H]3CCCN3S(=O)(=O)c3ccc4cc[nH]c4c3)CC2)cc1
CN(C)CC1CC2N(O1)c1ccccc1Cc1ncccc21
CC(=NOC(=O)Nc1ccccc1)c1cccc(c1)-c1cccs1 |w:2.2|
COc1cccc(F)c1OC1CN(Cc2cnn(c2C)-c2ccccc2)C1
COc1ccc(OC)c(c1)C1CCN(Cc2cnn(c2C)-c2ccccc2F)C1
Cc1c(cc(n1C)C(C)(C)C)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1C
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1ccc(Cl)cc1Cl
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1ccccc1Br
COc1cccc(N2CCN(CCCNC(=O)c3cc(-c4ccccc4)n(C)c3C)CC2)c1OC
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1ccc(F)cc1
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc2cccnc12
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc2ccc(C)nc12
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCCN1CCN(CC1)c1ccncc1
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1ccc(Cl)c(Cl)c1
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Br)c1
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1ccccc1OC
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(OC)c1
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(OC)c1OC
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cc(F)ccc1F
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(c1)C(F)(F)F
CCCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc2cccnc12
CCCn1c(C)c(cc1-c1ccccc1)C(=O)N(C)CCCN1CCN(CC1)c1cccc(C)c1C
CN(CCCN1CCN(CC1)c1cccc(Cl)c1Cl)C(=O)c1cc(-c2ccccc2)n(C)c1C
CCCn1c(C)c(cc1-c1ccccc1)C(=O)N(C)CCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1[nH]c(c(C)c1C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccccc1
Cc1c(C(=O)NCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n(C)c1-c1ccccc1
CCCn1c(C)c(C(=O)NCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)c1-c1ccccc1
Cc1[nH]c(c(C)c1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccccc1
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C)-c1ccc(Cl)cc1
Cc1c(cc(-c2ccc(Cl)cc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCn1c(C)c(cc1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCn1c(C)c(cc1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccc(Cl)cc1
Cc1c(cc(-c2ccc(Cl)cc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCn1c(C)c(cc1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl)-c1ccccn1
Cc1c(cc(-c2ccccn2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccccn1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2cccnc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1cccnc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccncc2)n1C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)c(cc1-c1ccncc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(n1C)C(C)(C)C)C(=O)NCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(n1C)C(C)(C)C)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(cc(n1C)C(C)(C)C)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1[nH]c(cc1C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl)C(C)(C)C
Cc1c(cc(n1C)C(C)(C)C)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(cc(-c2ccccc2)n1C)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1C
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccc3c(c[nH]c23)C#N)cc1
COc1ccc(NC(=O)Nc2ccc(F)cc2F)cc1-c1c(Br)cnn1C |(4.32,-10.34,;4.33,-11.88,;3,-12.66,;1.65,-11.89,;.32,-12.66,;.33,-14.2,;-1,-14.97,;-2.33,-14.2,;-2.34,-12.66,;-3.67,-14.97,;-5,-14.21,;-6.34,-14.98,;-7.67,-14.21,;-7.67,-12.66,;-9.01,-11.89,;-6.34,-11.89,;-5.01,-12.66,;-3.68,-11.88,;1.67,-14.97,;3,-14.2,;4.33,-14.97,;4.09,-16.48,;2.72,-17.18,;5.46,-17.18,;6.55,-16.08,;5.84,-14.71,;6.54,-13.34,)|
Cn1cc(Cl)c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
COc1ccc(NC(=O)N2CCN(CCc3ccc(F)cc3)CC2)cc1-c1c(Cl)cnn1C |(-7.16,5.97,;-7.15,4.43,;-5.82,3.66,;-4.5,4.43,;-3.16,3.67,;-3.15,2.12,;-1.82,1.35,;-.48,2.12,;-.49,3.66,;.85,1.35,;2.17,2.13,;3.51,1.35,;3.51,-.19,;4.84,-.96,;6.17,-.19,;7.5,-.97,;8.82,-.21,;10.15,-.97,;10.15,-2.52,;11.48,-3.29,;8.82,-3.29,;7.49,-2.51,;2.17,-.96,;.84,-.19,;-4.49,1.35,;-5.82,2.12,;-7.16,1.35,;-7.09,-.18,;-5.81,-1.03,;-8.54,-.72,;-9.49,.49,;-8.64,1.77,;-9.17,3.22,)|
Fc1ccc(CCN2CCN(CC2)C(=O)Nc2[nH]ncc2Br)cc1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2ccc(F)cc2)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2ccccc2)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2ccccc2F)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2cccc(F)c2)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2ccc(Cl)cc2)CC1
COc1ccc(CCN2CCN(CC2)C(=O)c2nn(C)cc2Br)cc1
Cn1cc(Br)c(n1)C(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)C(=O)c1nn(C)cc1Br
Cn1cc(Br)c(n1)C(=O)N1CCN(CCN2C(=O)c3ccccc3C2=O)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2F)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(=O)c2ccccc2F)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(=O)c2ccc(cc2)C(F)(F)F)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(=O)c2ccc(OC(F)(F)F)cc2)CC1
Cn1cc(Br)c(n1)C(=O)N1CCN(CC(O)c2ccc(F)cc2)CC1
CO\N=C(\CN1CCN(CC1)C(=O)c1nn(C)cc1Br)c1ccc(F)cc1
Cn1ccc(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cc1c(Br)c(nn1C)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cc1n[nH]c(C(=O)N2CCN(CC(=O)c3ccc(F)cc3)CC2)c1Br
Cc1cc([nH]n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cc1cc(nn1C)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cc1cc(nn1C(C)(C)C)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
CCn1cc(Cl)c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Fc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1[nH]ncc1Cl
Cn1cc(c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1)C(F)(F)F
Cn1cc(I)c(n1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
Cc1cc(nn1-c1ccccc1)C(=O)N1CCN(CC(=O)c2ccc(F)cc2)CC1
CN1CCN(CC1)c1cccc(c1)N(Cc1ccccc1)S(=O)(=O)c1ccc2ccccc2c1
CN1CCN(CC1)c1cccc(c1)N(CC1CC1)S(=O)(=O)c1ccc2ccccc2c1
CC(C)N(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1ccc2ccccc2c1
CC(C)N(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1cccc2ccccc12
CC(C)N(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1ccccc1
CCN(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1ccc2ccccc2c1
CCCN(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1ccc2ccccc2c1
CN(c1cccc(c1)N1CCN(C)CC1)S(=O)(=O)c1ccc2ccccc2c1
CN1CCN(CC1)c1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1
O=C1N(CCN2CCC(CC2)n2ccc3ccccc23)CCCc2ccccc12
Fc1ccc2n(ccc2c1)C1CCN(CCN2CCCc3ccccc3C2=O)CC1
O=C1N(CCN2CCC(CC2)Oc2ccccc2)CCCc2ccccc12
Fc1ccc2n(C3CCN(CCN4CCCc5ccccc5C4=O)CC3)c(=O)oc2c1
O=C1N(CCN2CCC(CC2)n2nnc3ccccc23)CCCc2ccccc12
O=C1Cc2ccccc2N1C1CCN(CCN2CCCc3ccccc3C2=O)CC1
Clc1ccc(cc1)C(=O)C1CCN(CCN2CCCc3ccccc3C2=O)CC1
Cc1ccc(OC2CCN(CCN3CCCc4ccccc4C3=O)CC2)cc1
Fc1ccc2N(C3CCN(CCN4CCCc5ccccc5C4=O)CC3)C(=O)Cc2c1
Fc1ccc(OC2CCN(CCN3CCCc4ccccc4C3=O)CC2)cc1
Fc1ccc2n(nnc2c1)C1CCN(CCN2CCCc3ccccc3C2=O)CC1
Fc1ccc2n(C3CCN(CCN4CCCc5ccccc5C4=O)CC3)c(=O)[nH]c2c1
Oc1nc2ccccc2n1C1CCN(CCN2CCCc3ccccc3C2=O)CC1
Clc1ccc(OC2CCN(CCN3CCCc4ccccc4C3=O)CC2)cc1
O=C1N(CCN2CCC(CC2)c2c[nH]c3ccccc23)CCCc2ccccc12
O=C1N(CCN2CCC(CC2)n2c3ccccc3oc2=O)CCCc2ccccc12
Fc1ccc(cc1)C(=O)C1CCN(CCN2CCCc3ccccc3C2=O)CC1
Fc1ccc2SCC3CON(C3c2c1)C(=O)Nc1ccccc1
CC(C)NC(=O)N1OCC2CSc3ccc(F)cc3C12
CCCNC(=O)N1OCC2CSc3ccc(F)cc3C12
Fc1ccc2SCC3CON(C3c2c1)C(=O)NC1CCCCC1
CCCCNC(=O)N1OCC2CSc3ccc(F)cc3C12
O=C(Nc1ccccc1)N1OCC2COc3ccccc3C12
CC(C)NC(=O)N1OCC2COc3ccccc3C12
CCCNC(=O)N1OCC2COc3ccccc3C12
O=C(NC1CCCCC1)N1OCC2COc3ccccc3C12
CC(C)(C)NC(=O)N1OCC2COc3ccccc3C12
CCCCNC(=O)N1OCC2COc3ccccc3C12
Cc1ccccc1NC(=O)N1OCC2COc3ccccc3C12
COc1ccc2C(=O)CC(CN3CCC(CC3)c3noc4cc(F)ccc34)Cc2c1
Fc1ccc2c(noc2c1)C1CCN(CC2CC(=O)c3ccccc3C2)CC1
COc1ccccc1N1CCN(CC2CC(=O)c3ccccc3C2)CC1
COc1cc2CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)CC(=O)c2cc1OC
COc1cc2CC(CN3CCN(CC3)c3ccccc3OC)CC(=O)c2cc1OC
COc1cc2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c2cc1OC
COc1ccc2C(=O)CC(CN3CCN(CC3)c3ccccn3)Cc2c1
O=C1CC(CN2CCN(CC2)c2ccccn2)Cc2ccccc12
COc1ccc2C(=O)CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)Cc2c1
Fc1ccc(cc1)C(=O)C1CCN(CC2CC(=O)c3ccccc3C2)CC1
COc1cc2CC(CN3CCN(CC3)c3ccccn3)CC(=O)c2cc1OC
COc1ccc2C(=O)CC(CN3CCN(CC3)c3ccccc3OC)Cc2c1
C[C@H]1Cc2c([nH]c3cc(Cl)c(F)cc23)[C@@]2(N1)C(=O)Nc1ccc(Cl)cc21 |r|
C(CCN1CCN(CC1)c1cccc2ccccc12)COc1ccc2CNCc2c1
Fc1ccc2c(cccc2c1)N1CCN(CCCOc2ccc3CNC(=O)c3c2F)CC1
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCOCc34)cc12
Fc1cc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c2cc1F
Fc1cccc2cccc(N3CCN(CCCOc4cc5C(=O)NCc5cc4Cl)CC3)c12
Clc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2ccccc12
Cc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Cc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4OCCc34)cc12
Cc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2cccc(F)c12
Cc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2ccccc12
Cc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNCc5c4)CC3)c2c1
Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNCc5c4)CC3)c2c1
Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4F)CC3)c2c1
Fc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4Cl)CC3)c12
Fc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
Cc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2ccccc12
C(COc1ccc2CNCc2c1)CN1CCN(CC1)c1cccc2ccccc12
Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Clc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c2c1
Fc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Fc1ccc2cccc(N3CCN(CCCOc4cc5C(=O)NCc5cc4F)CC3)c2c1
Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2ccc3CNC(=O)c3c2F)CC1
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4CCCc34)cc12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCCc34)cc12
Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2cccc(F)c12
Fc1ccc2c(cccc2c1)N1CCN(CCCOc2ccc3CNC(=O)c3c2)CC1
Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4Cl)CC3)c12
Cc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2cccc(F)c12
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4OCCc34)cc12
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4CCCCc34)cc12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4ccccc34)cc12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4COCc34)cc12
Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2ccc3CNC(=O)c3c2)CC1
Fc1ccc2cccc(N3CCN(CCCCOc4cc5C(=O)NCc5cc4F)CC3)c2c1
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCc34)cc12
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4CCOCc34)cc12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4COCCc34)cc12
Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c12
Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cc(F)ccc12
Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Cc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2cc(F)ccc12
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4ccccc34)cc12
Cc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
O=C1NCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCOc34)cc12
Fc1cc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c2cc1F
Clc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
O=C1NCc2ccc(OCCCN3CCN(CC3)c3cccc4CCCOc34)cc12
Fc1cccc2cccc(N3CCN(CCCCOc4cc5C(=O)NCc5cc4Cl)CC3)c12
Cc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2cc(F)ccc12
Fc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2ccccc12
CCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1
CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3OCCOc23)CC1
CCCCN1CCC(COC(=O)c2cc(F)c(N)c3OCCOc23)CC1
OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Cc1ccc(C)c(c1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1ccc(Cl)cc1
OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1ccc(Cl)cc1
Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1cc(C)ccc1C
Clc1ccc(cc1)N1CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1
Cc1ccc(C)c(c1)C(=O)CCCN1CCC(CC1)c1ccc(Cl)cc1
O=C(CCCN1CCC(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Cc1ccc(C)c(c1)C1CCN(CCCC(=O)c2cc(C)ccc2C)CC1
O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2ccccc2s1
Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
COc1ccccc1N1CCN(CCCCNC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Cc1ccc(C)c(c1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1
Cc1ccc(CNCC2(F)CCN(CC2)C(=O)c2cc(Br)cs2)nc1
Cc1ccc(CNCC2(F)CCN(CC2)C(=O)c2csc3ccccc23)nc1
Cc1ccc(CNCC2(F)CCN(CC2)C(=O)c2coc3ccccc23)nc1
Cc1ccc(nc1)CNCC2(CCN(CC2)C(=O)c3ccc(c(c3)Cl)F)F
COc1c(C)nc(C)nc1C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
COc1c(C)nc(C)nc1C(=O)NCCN1CCN(CC1)c1cccc(C)c1C
COc1c(C)nc(C)nc1C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1cc(nc(n1)C1CC1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CSc1nc(C)cc(n1)C(=O)NCCN1CCN(CC1)c1cccc(Cl)c1Cl
CSc1nc(C)cc(n1)C(=O)NCCN1CCN(CC1)c1cccc(C)c1C
CSc1nc(C)cc(n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1cc(nc(n1)C(C)(C)C)C(=O)NCCN1CCN(CC1)c1cccc(C)c1C
Cc1cc(nc(n1)C(C)(C)C)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1nc(cc(n1)C(C)(C)C)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1nc(cc(n1)-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CN(C)[C@@H]1CC[C@@H](C1)c1c[nH]c2ccc(cc12)C#N |r|
CN(C)[C@H]1CC[C@H](C1)c1c[nH]c2ccc(F)cc12 |r|
COc1ccccc1N1CCN(CCCCNC(=O)\C=C\c2ccc(F)cc2)CC1
FC(F)(F)C1CCN(CCN2CCN(C2=O)c2cccc(c2)C#N)CC1
CN1CCN(CC1)c1ccc2C(=O)CCN(c2c1)S(=O)(=O)c1ccc2ccccc2c1
CN1CCN(CC1)c1cccc2N(CCC(=O)c12)S(=O)(=O)c1ccc2ccccc2c1
CC1CC(=O)c2ccc(cc2N1S(=O)(=O)c1ccc2ccccc2c1)N1CCN(C)CC1
CC1CC(=O)c2c(cccc2N1S(=O)(=O)c1ccc2ccccc2c1)N1CCN(C)CC1
CCC1CC(=O)c2c(cccc2N1S(=O)(=O)c1ccc2ccccc2c1)N1CCN(C)CC1
CC1CC(=O)c2c(cc(C)cc2N1S(=O)(=O)c1ccc2ccccc2c1)N1CCN(C)CC1
Fc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1
Fc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1
COc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1
C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1cccnc1
CCNc1c2CCNCCc2nc2ccnn12
C1CCN(CC1)c1c2CCNCCc2nc2ccnn12
Fc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12
O=C1Cc2cc(OC3CN(C3)c3c4CCNCCc4nc4ccnn34)ccc2N1
C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccncc1
CN(C(C)=O)c1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1
C1CCN(C1)c1c2CCNCCc2nc2ccnn12
C1CN(C1)c1c2CCNCCc2nc2ccnn12
COc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1
COc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12
C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccn1
C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccc1
Fc1cccc(CCN[C@@H]2C3C4CC5C6CC(C3C46)C25)c1 |r,THB:10:17:15:13.19,9:19:17.18:15,11:18:15:13.19,12:13:17.18:15|
CN(CCc1cccc(F)c1)[C@@H]1C2C3CC4C5CC(C2C35)C14 |r,THB:12:19:17:15.21,11:21:19.20:17,13:20:17:15.21,14:15:19.20:17|
CCCN1CCc2cccc-3c2C1Cc1cccc(OCCCCN2CCN(CC2)c2ccccc2OC)c-31
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OCc2cn(CCCCN4CCN(CC4)c4ccccc4OC)nn2)c-31 |r|
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OCCCn2cc(CCN4CCN(CC4)c4ccccc4OC)nn2)c-31 |r|
COc1ccccc1N1CCN(CCCCN2CCc3ccccc3C2=O)CC1
COc1ccccc1N1CCN(CCCCN2CCCc3ccccc3C2=O)CC1
COc1ccc2c(CCCN(CCCCN3CCN(CC3)c3ccccc3OC)C2=O)c1
COc1ccccc1N1CCN(CCCCN2CCc3cc(F)ccc3C2=O)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)-c2ccccc2)CC1
COc1ccccc1N1CCN(CCCCN2CCc3c(cccc3-c3ccccc3)C2=O)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)-c2ccco2)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)-c2cccs2)CC1
COc1ccccc1N1CCN(CCCCN2CCCc3cc(ccc3C2=O)-c2cccs2)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)-c2ccncc2)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)C#N)CC1
COc1ccccc1N1CCN(CCCCN2CCc3cc(ccc3C2=O)C#C)CC1
Clc1cccc(N2CCN(CCCCCc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ccc4ccc(=O)[nH]c4n3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3cc4[nH]c(=O)ccc4cn3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCOc3ncc4ccc(=O)[nH]c4n3)CC2)c1Cl
Clc1ccccc1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Fc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
Cc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
Cc1ccccc1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Cc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1C
Cc1c(Cl)cccc1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Fc1c(Cl)cccc1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
FC(F)(F)c1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c1Cl
FC(F)(F)c1c(Cl)cccc1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCc34)nc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCCc34)nc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4OCCCc34)nc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4CCCOc34)nc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3cccc4ccccc34)nc2N1
Fc1ccc2ccccc2c1N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Fc1cc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c2ccccc2c1
Fc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4n3)CC2)c2ccccc12
Fc1cccc2c(cccc12)N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2ccc3CCC(=O)Nc3n2)CC1
Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CCC(=O)Nc5n4)CC3)c2c1
Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CCC(=O)Nc5n4)CC3)c12
FC(CCNC(=O)c1cc2ccccc2o1)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CC(F)CCNC(=O)c2ccc-3c(Cc4ccccc-34)c2)CC1
COc1ccccc1N1CCN(CC(F)CCNC(=O)c2ccc(cc2)-c2ccccn2)CC1
FC(CCNC(=O)c1ccc(cc1)-c1ccccn1)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CC(F)CCNC(=O)c2cc3ccccc3o2)CC1
COc1ccc2oc(cc2c1)C(=O)NCCC(F)CN1CCN(CC1)c1ccccc1OC
COc1ccc2oc(cc2c1)C(=O)NCCC(F)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CC(F)CCNC(=O)c2cc3ccccc3[nH]2)CC1
FC(CCNC(=O)c1cc2ccccc2[nH]1)CN1CCN(CC1)c1cccc(Cl)c1Cl
FC(CCNC(=O)c1ccc-2c(Cc3ccccc-23)c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccccc1N1CCN(CC(F)CCNC(=O)c2cc3ccccc3s2)CC1
FC(CCNC(=O)c1cc2ccccc2s1)CN1CCN(CC1)c1cccc(Cl)c1Cl
COc1ccc2[nH]c(cc2c1)C(=O)NCCC(F)CN1CCN(CC1)c1ccccc1OC
COc1ccc2[nH]c(cc2c1)C(=O)NCCC(F)CN1CCN(CC1)c1cccc(Cl)c1Cl
FC(CCNC(=O)c1ccc2ccccc2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
CN(CCC(F)CN1CCN(CC1)c1cccc(Cl)c1Cl)Cc1ccc-2c(Cc3ccccc-23)c1
O=c1n(CCN2CCN(CC2)c2cccc3ccccc23)nnc2ccccc12
O=C1C2C3CC(C=C3)C2C(=O)N1OCCCN1CCN(CC1)c1cccc2ccccc12 |c:6|
N#CNC(=NCCCN1CCN(CC1)c1cccc2ccccc12)c1ccncc1 |w:4.4|
N#CNC(=NCCCN1CCN(CC1)c1cccc2ccccc12)c1ccccn1 |w:4.4|
O=c1n(CCCN2CCN(CC2)c2cccc3ccccc23)nnc2ccccc12
O=c1n(OCCCN2CCN(CC2)c2cccc3ccccc23)nnc2ccccc12
O=C1C2C3CC(C=C3)C2C(=O)N1OCCN1CCN(CC1)c1cccc2ccccc12 |c:6|
O=c1n(OCCN2CCN(CC2)c2cccc3ccccc23)nnc2ccccc12
CCCN1CCc2cccc-3c2[C@H]1Cc1cccc(OC(=O)NCc2ccccc2)c-31 |r|
COc1ccc(cc1)-n1c(C)c(nc1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(C)c1C
COc1ccc(cc1OC)-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c1C
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1F |(18.19,-11.72,;18.96,-10.39,;20.5,-10.39,;20.98,-8.93,;22.32,-8.16,;22.32,-6.62,;23.65,-8.93,;24.98,-8.16,;26.32,-8.93,;26.32,-10.47,;27.65,-8.16,;28.98,-8.92,;30.3,-8.14,;31.63,-8.91,;31.64,-10.45,;30.31,-11.22,;28.97,-10.46,;32.97,-11.21,;34.31,-10.43,;35.64,-11.2,;35.65,-12.74,;34.31,-13.51,;34.31,-15.05,;32.98,-12.75,;31.64,-13.52,;19.73,-8.02,;19.73,-6.48,;18.49,-8.93,;17.16,-8.15,;17.16,-6.62,;15.83,-5.84,;14.49,-6.61,;14.49,-8.16,;15.83,-8.93,;15.83,-10.47,)|
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1F |(-5.7,-19.76,;-4.92,-18.43,;-3.38,-18.43,;-2.9,-16.97,;-1.57,-16.2,;-1.57,-14.66,;-.24,-16.97,;1.1,-16.2,;2.43,-16.97,;2.43,-18.51,;3.76,-16.2,;5.09,-16.96,;6.42,-16.19,;7.75,-16.95,;7.76,-18.49,;6.42,-19.27,;5.08,-18.5,;9.09,-19.26,;10.42,-18.48,;11.76,-19.24,;11.76,-20.78,;10.42,-21.56,;10.42,-23.1,;9.09,-20.79,;7.76,-21.56,;-4.15,-16.06,;-4.16,-14.52,;-5.4,-16.97,;-6.73,-16.2,;-6.72,-14.66,;-8.06,-13.88,;-9.4,-14.65,;-9.4,-16.2,;-8.06,-16.97,;-8.05,-18.51,)|
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1F |(17.63,-21.49,;18.4,-20.16,;19.94,-20.16,;20.42,-18.7,;21.76,-17.93,;21.76,-16.39,;23.09,-18.7,;24.42,-17.93,;25.76,-18.7,;25.76,-20.24,;27.09,-17.93,;28.42,-18.69,;29.74,-17.91,;31.07,-18.68,;31.08,-20.22,;29.75,-20.99,;28.41,-20.23,;32.41,-20.98,;33.75,-20.2,;35.08,-20.97,;35.09,-22.51,;33.75,-23.28,;33.75,-24.82,;32.42,-22.52,;31.08,-23.29,;19.17,-17.79,;19.17,-16.25,;17.93,-18.7,;16.6,-17.92,;16.6,-16.38,;15.27,-15.61,;13.93,-16.38,;13.93,-17.93,;15.27,-18.69,;15.27,-20.23,)|
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc(F)cc1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(F)cc1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc(F)cc1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(F)cc1
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(C)c1C
COc1ccc(cc1)-n1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c1C
COc1ccc(cc1)-n1c(C)c(nc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1C
COc1ccc(cc1)-n1c(C)c(nc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1F |(-6.05,-10.44,;-5.27,-9.11,;-3.73,-9.11,;-3.25,-7.64,;-1.92,-6.87,;-1.92,-5.33,;-.59,-7.64,;.75,-6.87,;2.08,-7.64,;3.41,-6.87,;4.74,-7.64,;6.07,-6.86,;7.4,-7.62,;7.41,-9.17,;6.07,-9.94,;4.73,-9.17,;8.74,-9.93,;10.07,-9.15,;11.41,-9.91,;11.41,-11.46,;10.07,-12.23,;10.07,-13.77,;8.74,-11.46,;7.41,-12.23,;-4.5,-6.74,;-4.51,-5.2,;-5.75,-7.64,;-7.08,-6.87,;-7.07,-5.33,;-8.41,-4.56,;-9.75,-5.33,;-9.74,-6.88,;-8.41,-7.64,;-8.41,-9.18,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(F)cc1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc(F)cc1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(F)cc1
CCCc1nc(cn1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1C
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1Cl |(-4.3,-45.95,;-3.52,-44.62,;-1.98,-44.62,;-1.5,-43.16,;-.17,-42.39,;-.17,-40.85,;1.16,-43.16,;2.5,-42.39,;3.83,-43.16,;5.16,-42.39,;6.49,-43.15,;7.82,-42.37,;9.15,-43.14,;9.16,-44.68,;7.82,-45.45,;6.48,-44.69,;10.49,-45.44,;11.82,-44.66,;13.16,-45.43,;13.16,-46.97,;11.82,-47.74,;11.82,-49.28,;10.49,-46.98,;9.16,-47.75,;-2.75,-42.25,;-2.76,-40.71,;-4,-43.16,;-5.33,-42.38,;-5.32,-40.85,;-6.66,-40.07,;-8,-40.84,;-7.99,-42.39,;-6.66,-43.16,;-6.66,-44.7,)|
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1Cl |(-8.42,-1.08,;-7.64,.25,;-6.1,.25,;-5.33,1.58,;-3.79,1.58,;-3.31,3.04,;-1.97,3.81,;-1.97,5.35,;-.64,3.04,;.69,3.81,;2.03,3.04,;3.36,3.81,;4.69,3.05,;6.01,3.83,;7.34,3.06,;7.35,1.52,;6.02,.75,;4.68,1.51,;8.68,.76,;10.02,1.54,;11.35,.77,;11.36,-.77,;10.02,-1.54,;10.02,-3.08,;8.69,-.78,;7.35,-1.55,;-4.56,3.95,;-4.56,5.49,;-5.8,3.04,;-7.13,3.82,;-7.13,5.35,;-8.46,6.13,;-9.8,5.36,;-9.8,3.81,;-8.46,3.04,;-8.46,1.5,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1cccc(Cl)c1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(Cl)cc1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc2OCCOc2c1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc2OCCOc2c1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc2OCCOc2c1
Cc1c(nc(-c2ccccc2)n1-c1ccc2OCCOc2c1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1
Cc1c(nc(-c2ccccc2)n1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1C
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1C1CCCC1
COc1ccccc1-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c1C |(-6.15,-25.82,;-6.16,-27.36,;-7.49,-28.12,;-8.83,-27.35,;-10.17,-28.12,;-10.17,-29.67,;-8.83,-30.43,;-7.5,-29.66,;-6.17,-30.43,;-5.69,-31.9,;-6.47,-33.23,;-4.15,-31.9,;-3.67,-30.43,;-2.34,-29.66,;-2.34,-28.12,;-1.01,-30.43,;.33,-29.66,;1.66,-30.43,;1.66,-31.97,;2.99,-29.66,;4.32,-30.43,;5.65,-29.65,;6.98,-30.41,;6.99,-31.95,;5.65,-32.73,;4.31,-31.96,;8.32,-32.72,;9.65,-31.94,;10.99,-32.7,;10.99,-34.25,;9.65,-35.02,;9.65,-36.56,;8.32,-34.25,;6.99,-35.02,;-4.92,-29.52,;-4.93,-27.98,)|
COc1ccc(cc1)-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c1C
COc1ccc(cc1)-n1c(C)nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c1C
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc(OC)cc1
COc1ccc(cc1)-n1c(C)c(nc1-c1ccccc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1C
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1C
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1Cl |(17.54,-.1,;18.32,1.23,;19.86,1.23,;20.34,2.69,;21.67,3.46,;21.67,5,;23,2.69,;24.34,3.46,;25.67,2.69,;25.67,1.15,;27,3.46,;28.33,2.7,;29.66,3.48,;30.99,2.71,;31,1.17,;29.66,.4,;28.32,1.16,;32.33,.41,;33.66,1.19,;35,.42,;35,-1.12,;33.66,-1.89,;33.66,-3.43,;32.33,-1.13,;31,-1.9,;19.09,3.6,;19.08,5.14,;17.84,2.69,;16.51,3.47,;16.52,5,;15.18,5.78,;13.84,5.01,;13.84,3.46,;15.18,2.69,;15.19,1.15,)|
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1cccc(Cl)c1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1cccc(Cl)c1
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1Cl
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCC(O)CN1CCN(CC1)c1cccc(Cl)c1C
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc(Cl)cc1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc2OCCOc2c1
Cc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc2OCCOc2c1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc2OCCOc2c1
CCCc1nc(C(=O)NCC(O)CN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc2OCCOc2c1
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NC[C@@H](O)CN1CCN(CC1)c1cccc(Cl)c1C |r|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1C(F)(F)F |(19.14,-42.83,;19.91,-41.5,;21.45,-41.5,;21.93,-40.04,;23.26,-39.27,;23.26,-37.73,;24.6,-40.04,;25.93,-39.27,;27.27,-40.04,;28.6,-39.27,;29.93,-40.03,;31.25,-39.26,;32.58,-40.02,;32.59,-41.56,;31.26,-42.33,;29.91,-41.57,;33.92,-42.32,;33.93,-43.86,;35.26,-44.63,;36.6,-43.85,;36.59,-42.31,;37.92,-41.53,;35.25,-41.55,;35.25,-40.01,;20.68,-39.13,;20.68,-37.59,;19.44,-40.04,;18.1,-39.27,;18.11,-37.73,;16.78,-36.95,;15.44,-37.72,;15.44,-39.27,;16.78,-40.04,;16.78,-41.58,;15.45,-42.35,;18.11,-42.34,;16.77,-43.11,)|
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccc2OCCOc2c1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1C1CCCC1
Cc1c(nc(-c2ccccc2)n1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Cc1c(nc(-c2ccccc2)n1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCCn1c(C)nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c1C
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1C1CCCC1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1OC |(-8.68,-8.22,;-7.77,-6.98,;-6.24,-7.14,;-5.34,-5.9,;-3.8,-5.9,;-3.32,-4.43,;-1.98,-3.66,;-1.98,-2.12,;-.65,-4.43,;.68,-3.66,;2.02,-4.43,;3.35,-3.66,;4.68,-4.43,;6.01,-3.65,;7.33,-4.41,;7.34,-5.95,;6.01,-6.73,;4.67,-5.96,;8.68,-6.72,;8.68,-8.25,;10.01,-9.02,;11.35,-8.24,;11.34,-6.7,;12.67,-5.93,;10.01,-5.94,;10,-4.4,;-4.57,-3.52,;-4.57,-1.98,;-5.81,-4.43,;-7.14,-3.66,;-8.47,-4.43,;-9.8,-3.66,;-9.81,-2.12,;-8.47,-1.35,;-7.14,-2.12,;-5.8,-1.35,;-5.79,.19,)|
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1F |(15.2,-27.43,;16.1,-26.18,;17.64,-26.34,;18.54,-25.1,;20.08,-25.1,;20.56,-23.64,;21.9,-22.87,;21.9,-21.33,;23.23,-23.64,;24.56,-22.87,;25.9,-23.64,;27.23,-22.87,;28.56,-23.63,;29.88,-22.85,;31.21,-23.62,;31.22,-25.16,;29.89,-25.93,;28.55,-25.16,;32.55,-25.92,;32.56,-27.45,;33.89,-28.22,;35.23,-27.45,;35.22,-25.91,;36.55,-25.13,;33.89,-25.14,;33.88,-23.6,;19.31,-22.73,;19.31,-21.19,;18.07,-23.64,;16.74,-22.86,;15.41,-23.63,;14.07,-22.87,;14.07,-21.32,;15.41,-20.55,;16.74,-21.32,;18.08,-20.56,)|
Cc1c(nc(-c2ccccc2)n1-c1ccccc1F)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl |(-4.38,-26.81,;-4.38,-28.35,;-3.13,-29.26,;-3.61,-30.72,;-5.15,-30.72,;-5.92,-32.05,;-7.46,-32.04,;-8.24,-33.37,;-7.47,-34.71,;-5.93,-34.71,;-5.16,-33.38,;-5.62,-29.26,;-6.96,-28.49,;-8.28,-29.26,;-9.62,-28.49,;-9.62,-26.94,;-8.28,-26.17,;-6.95,-26.95,;-5.61,-26.18,;-1.8,-28.49,;-1.8,-26.95,;-.46,-29.26,;.87,-28.49,;2.21,-29.26,;3.54,-28.49,;4.87,-29.25,;6.19,-28.48,;7.52,-29.24,;7.53,-30.78,;6.2,-31.55,;4.85,-30.79,;8.86,-31.54,;8.87,-33.08,;10.2,-33.85,;11.54,-33.07,;11.53,-31.53,;12.86,-30.75,;10.19,-30.77,;10.19,-29.23,)|
Cc1c(nc(-c2ccccc2)n1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1C
Cc1cccc(N2CCN(CCCNC(=O)c3cn(c(n3)-c3ccccc3)-c3ccccc3)CC2)c1C
Cc1c(Cl)cccc1N1CCN(CCCNC(=O)c2nc(-c3ccccc3)n(c2Cn2cncn2)-c2ccccc2)CC1
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccccc1OC |(-8.13,-19.75,;-7.35,-18.42,;-5.81,-18.43,;-5.04,-17.09,;-3.5,-17.1,;-3.02,-15.63,;-1.69,-14.86,;-1.69,-13.32,;-.35,-15.63,;.98,-14.86,;2.31,-15.63,;3.65,-14.86,;4.98,-15.63,;6.3,-14.85,;7.63,-15.61,;7.64,-17.15,;6.31,-17.93,;4.96,-17.16,;8.97,-17.92,;10.3,-17.14,;11.64,-17.9,;11.65,-19.44,;10.31,-20.22,;10.31,-21.76,;8.98,-19.45,;7.64,-20.22,;-4.27,-14.72,;-4.27,-13.18,;-5.51,-15.63,;-6.85,-14.86,;-8.17,-15.63,;-9.51,-14.86,;-9.52,-13.31,;-8.17,-12.55,;-6.84,-13.32,;-5.5,-12.55,;-5.5,-11.01,)|
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccccc1OC |(14.87,-21.94,;15.64,-20.61,;17.18,-20.61,;17.96,-19.28,;19.5,-19.28,;19.98,-17.82,;21.31,-17.05,;21.31,-15.51,;22.65,-17.82,;23.98,-17.05,;25.31,-17.82,;26.65,-17.05,;27.98,-17.81,;29.3,-17.03,;30.63,-17.8,;30.64,-19.34,;29.3,-20.11,;27.96,-19.35,;31.97,-20.1,;33.3,-19.32,;34.64,-20.09,;34.64,-21.63,;33.3,-22.4,;33.31,-23.94,;31.97,-21.64,;30.64,-22.41,;18.73,-16.91,;18.73,-15.37,;17.49,-17.82,;16.15,-17.04,;14.82,-17.82,;13.49,-17.05,;13.48,-15.5,;14.83,-14.73,;16.16,-15.51,;17.49,-14.74,;17.5,-13.2,)|
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2Cl)c(C)n1-c1ccccc1Cl |(19.54,-34.68,;20.32,-33.35,;21.86,-33.35,;22.33,-31.89,;23.67,-31.12,;23.67,-29.58,;25,-31.89,;26.34,-31.12,;27.67,-31.89,;29,-31.12,;30.33,-31.88,;31.66,-31.1,;32.99,-31.87,;32.99,-33.41,;31.66,-34.18,;30.32,-33.42,;34.33,-34.17,;34.33,-35.71,;35.66,-36.47,;37,-35.7,;36.99,-34.16,;38.33,-33.38,;35.66,-33.39,;35.65,-31.85,;21.09,-30.98,;21.08,-29.44,;19.84,-31.89,;18.51,-31.11,;17.18,-31.89,;15.85,-31.12,;15.85,-29.57,;17.18,-28.8,;18.52,-29.58,;19.85,-28.81,)|
Cc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2C)c(C)n1-c1ccc(F)cc1
Cc1c(nc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
CCCc1nc(cn1-c1ccc(Cl)cc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1C
CCCc1nc(C(=O)NCCCN2CCN(CC2)c2cccc(C)c2C)c(C)n1-c1ccc2OCCOc2c1
COc1ccc(cc1)-n1c(C)c(nc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
COc1cc2CCN(CCCCn3cc(-c4ccc(F)cc4)c4ccccc34)Cc2cc1OC
Clc1ccc(cc1)N1CCN(CCCCC2C(=O)Nc3ccccc23)CC1 |w:15.15|
CCC1(CCCCN2CCN(CC2)c2ccc(Cl)cc2)C(=O)Nc2cc(F)ccc12 |w:2.1|
CCN=C(NS(=O)(=O)c1cccc(Cl)c1)N1CC(CC)C=N1 |w:2.1,c:21|
CCN=C(NS(=O)(=O)c1cccc(Cl)c1)N1N=CCC1c1ccccc1 |w:2.1,c:17|
Cc1c(CO)oc2cccc3n(cc1c23)S(=O)(=O)c1cccc2ccccc12
Cc1c(CO)oc2cccc3n(cc1c23)S(=O)(=O)c1ccccc1
OCc1cc2cn(c3cccc(o1)c23)S(=O)(=O)c1ccccc1
CCN(CC)Cc1cc2cn(c3cccc(o1)c23)S(=O)(=O)c1ccccc1
CN(C)Cc1cc2cn(c3cccc(o1)c23)S(=O)(=O)c1cccc2ccccc12
OCc1cc2cn(c3cccc(o1)c23)S(=O)(=O)c1cccc2ccccc12
CN(C)CC1=CC2=CN(C3=CC=CC(O1)C23)S(=O)(=O)c1ccccc1 |c:11,t:4,6,9|
COc1ccccc1N1CCN(CCCN2C(=O)COc3ccccc23)CC1
O=C1COc2ccccc2N1CCCN1CCN(CC1)c1nsc2ccccc12
Fc1ccc2c(noc2c1)C1CCN(CCCN2C(=O)COc3ccccc23)CC1
O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc23)CC1
O=C1COc2ccccc2N1CCCN1CCN(CC1)c1cccc2[nH]c(=O)oc12
Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl
COc1ccccc1N1CCN(CCCNS(=O)(=O)c2ccc3ncccc3c2)CC1
COc1ccccc1N1CCN(CCCNS(=O)(=O)c2cccc3cccnc23)CC1
O=S(=O)(NCCCCN1CCc2ccccc2C1)c1cnc2ccccc2c1
O=S(=O)(NCCCCN1CCc2ccccc2C1)c1ccc2ncccc2c1
O=S(=O)(NCCCCN1CCc2ccccc2C1)c1cccc2cccnc12
O=S(=O)(NCCCCN1CCc2sccc2C1)c1cnc2ccccc2c1
O=S(=O)(NCCCCN1CCc2sccc2C1)c1ccc2cccnc2c1
CCN(CCCN1CCN(CC1)c1ccccc1OC)S(=O)(=O)c1ccc2ncccc2c1
CCN(CCCCN1CCC2CCCCC2C1)S(=O)(=O)c1cnc2ccccc2c1
CCN(CCCCN1CCC2CCCCC2C1)S(=O)(=O)c1cccc2cccnc12
CCN(CCCCCN1CCC2CCCCC2C1)S(=O)(=O)c1cccc2cccnc12
Fc1ccc(CN2CCN(CC2)c2ccc3OCCOc3c2)cc1
COc1cc(CN2CCN(CC2)c2ccc3OCCOc3c2)ccc1F
Oc1cc(CN2CCN(CC2)c2ccc3OCCOc3c2)ccc1F
Fc1ccc(CN2CCN(CC2)c2ccc3OCCOc3c2)cn1
Oc1c2CSCn2c(=O)n1CCCCNCC1CCc2ccccc2O1
Oc1c2CCSn2c(=O)n1CCCCNCC1CCc2ccccc2O1
O=C1CN(CCCCNCC2CCc3ccccc3O2)C(=O)C2CCCCN12
O=C1CN(CCCCNCC2CCc3ccccc3O2)C(=O)C2CCCN12
Oc1c2CCCCn2c(=O)n1CCCCNCC1CCc2ccccc2O1
Oc1c2CCCn2c(=O)n1CCCCNC[C@@H]1CCc2ccccc2O1 |r|
Oc1c2CCCn2c(=O)n1CCCCNC[C@H]1CCc2ccccc2O1 |r|
Oc1c2CCCn2c(=O)n1CCCCNCc1ccc2ccccc2n1
Oc1c2CCCn2c(=O)n1CCCCNCCc1ccc2ccccc2c1
Oc1c2CCCn2c(=O)n1CCCCNCc1ccc2ccccc2c1
Oc1c2CCCn2c(=O)n1CCCCNCCc1cccc2ccccc12
Oc1csc(=O)n1CCCCCCCCNCC1CCc2ccccc2O1
Oc1csc(=O)n1CCCCCCNCC1CCc2ccccc2O1
Oc1csc(=O)n1CCCCCNCC1CCc2ccccc2O1
Oc1c2CCCn2c(=O)n1Cc1cccc(CNCC2CCc3ccccc3O2)c1
Oc1c2CCCn2c(=O)n1Cc1ccc(CNCC2CCc3ccccc3O2)cc1
Oc1c2CCCn2c(=O)n1C\C=C\CNCC1CCc2ccccc2O1
Oc1c2CCCn2c(=O)n1CCCCCCNCC1CCc2ccccc2O1
Oc1c2CCCn2c(=O)n1CCCCCNCC1CCc2ccccc2O1
Oc1c2CCCn2c(=O)n1CCCNCC1CCc2ccccc2O1
Oc1csc(=O)n1CCCCNCC1CCc2ccccc2O1
COc1ccccc1N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:15.15|
COc1ccc(cc1)N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:15.15|
CCOc1ccccc1N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:16.16|
N#CNC(=NCCCN1CCN(CC1)c1ccccc1C#N)c1ccccn1 |w:4.4|
Cc1cccc(N2CCN(CCCN=C(NC#N)c3ccccn3)CC2)c1C |w:13.12|
Clc1ccccc1N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:14.14|
Clc1cccc(c1)N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:14.14|
FC(F)(F)c1cccc(c1)N1CCN(CCCN=C(NC#N)c2ccccn2)CC1 |w:17.17|
N#CNC(=NCCCN1CCN(CC1)c1ncccn1)c1ccccn1 |w:4.4|
N#CNC(=NCCCN1CCN(CC1)c1ccccn1)c1ccccn1 |w:4.4|
N#CNC(=NCCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccccn1 |w:4.4|
O=C(N1CCN(CCCN=C(NC#N)c2ccccn2)CC1)c1ccco1 |w:9.8|
CN(C1CCN(C)CC1)S(=O)(=O)c1cccc(Cl)c1
CN(C1CCN(C)CC1)S(=O)(=O)c1cccc(C)c1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccccc1F
CN(C1CCN(C)CC1)S(=O)(=O)c1ccccc1Cl
CN(C1CCN(C)CC1)S(=O)(=O)c1ccccc1C
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(C)c(C)c1
CN(C1CCN(C)CC1)S(=O)(=O)c1cccc2ccccc12
CN(C1CCN(C)CC1)S(=O)(=O)c1cccc2ccsc12
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(F)cc1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(Cl)cc1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(I)cc1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccccc1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(C)cc1
CC(C)c1ccc(cc1)S(=O)(=O)N(C)C1CCN(C)CC1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(cc1)C(C)(C)C
CCc1ccc(cc1)S(=O)(=O)N(C)C1CCN(C)CC1
CCCc1ccc(cc1)S(=O)(=O)N(C)C1CCN(C)CC1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(cc1)-c1ccccc1
COc1ccc(cc1)S(=O)(=O)N(C)C1CCN(C)CC1
CCCCOc1ccc(cc1)S(=O)(=O)N(C)C1CCN(C)CC1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(OC(F)(F)F)cc1
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(cc1)C#N
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(cc1)C(F)(F)F
CN(C1CCN(C)CC1)S(=O)(=O)c1cccc(F)c1
Fc1ccc(SCCCN2CCC(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(OCCCN2CCC(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(cc1)S(=O)CCCN1CCC(CC1)c1ccc(Cl)cc1
Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(SCCCN2CCN(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(SCCCN2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1
Fc1ccc(OCCCN2CCN(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(OCCCN2CCN(CC2)c2ccccc2)cc1
Clc1ccc(cc1)N1CCN(CCCOc2ccccc2)CC1
C(COc1ccccc1)CN1CCN(CC1)c1ccccc1
Fc1ccc(CCCCN2CCN(CC2)c2ncccn2)cc1
Fc1ccc(SCCCN2CCN(CC2)c2ncccn2)cc1
Fc1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
Fc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Fc1ccc(SCCCN2CCN(CC2)c2ccccn2)cc1
Fc1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
Fc1ccc2C(=O)C(CCN3CCCN(CC3)c3ccc(Cl)cc3)Cc2c1
Fc1ccc(SCCCN2CCCN(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(OCCCN2CCCN(CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(CCCCN2CCCN(CC2)c2ccc(Cl)cc2)cc1
Clc1ccc(cc1)N1CCCN(CCCCc2nc3ccccc3s2)CC1
Clc1ccc(cc1)N1CCCN(CCCc2nc3ccccc3s2)CC1
Clc1ccc(cc1)N1CCCN(CCCCC(=O)c2nc3ccccc3s2)CC1
Clc1ccc(cc1)N1CCCN(CCCC(=O)c2nc3ccccc3s2)CC1
OC1(C[C@@H]2CC[C@H](C1)N2CCCCc1nc2ccccc2s1)c1ccc(Cl)cc1 |r,THB:9:8:2.1.7:5.4|
OC1(C[C@@H]2CC[C@H](C1)N2CCCOc1ccc(F)cc1)c1ccc(Cl)cc1 |r,THB:9:8:2.1.7:5.4|
OC1(C[C@@H]2CC[C@H](C1)N2CCCCc1ccc(F)cc1)c1ccc(Cl)cc1 |r,THB:9:8:2.1.7:5.4|
COc1cc(OC(C)C)cc(c1)S(=O)(=O)c1ccc2[C@@H]3CCNC[C@@H]3Oc2c1 |r|
Clc1ccc(cc1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1ccc(cc1)N1CCN(CC2CCN(CC2)S(=O)(=O)c2ccc3cccnc3c2)CC1
Clc1ccc(cc1)N1CCN(CC2CCN(CC2)S(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2ccc3ccccc3c2)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2cccc3ccccc23)CC1
Clc1ccc(cc1)N1CCN(CCCCCNS(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1ccc(cc1)N1CCN(CCCCNS(=O)(=O)c2cncc3ccccc23)CC1
Clc1ccc(cc1)N1CCN(CCCCNS(=O)(=O)c2ccc3cccnc3c2)CC1
Clc1ccc(cc1)N1CCN(CCCCNS(=O)(=O)c2ccc3ncccc3c2)CC1
Clc1ccc(cc1)N1CCN(CCCCNS(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2cccc3cccnc23)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2ccc3ncccc3c2)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2cnc3ccc(Cl)cc3c2)CC1
Clc1cccc(c1)N1CCN(CCCCNS(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1cccc(c1)N1CCN(CCCNS(=O)(=O)c2cnc3ccccc3c2)CC1
Clc1ccc(cc1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cnn3CCCCc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cnn3cc(Cl)ccc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cc3ccccn3n2)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cc3ncccn3n2)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cc(Br)cn3ccnc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cn3ccccc3n2)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cnn3cccnc23)c(F)c1
Cc1cc(C)n2ccnc2c1C(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Cc1nc2ccccn2c1C(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3cc(nc23)C#N)c(F)c1
Nc1cccn2cc(nc12)C(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cc3CCCCn3n2)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2nc3ccccn3c2Br)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cnn3ccccc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3cc(Br)nc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cnc3ccccn23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3ccnc23)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3cc(Cl)nc23)c(F)c1
Nc1cccc2nc(cn12)C(=O)N1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(CCN2CCN(CC2)C(=O)c2nn3ccccc3c2Br)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2nn3ccccc3c2Cl)c(F)c1
Fc1ccc(CCN2CCN(CC2)C(=O)c2cccc3ccnn23)c(F)c1
Clc1ccc2Sc3cccn3CC(N3CCN(CCN4CCNC4=O)CC3)c2c1
CN1CCN(CC1)C1=Cn2c(CO)ccc2Sc2ccccc12 |t:8|
CN1CCN(CC1)[C@@H]1Cn2cccc2Sc2ccc(Cl)cc12
CN1CCN(CC1)C1=Cn2cccc2Sc2ccc(Br)cc12 |t:8|
CN1CCCN(CC1)C1=Cn2cccc2Sc2ccc(Cl)cc12 |t:9|
CN1CCN(CC1)C1=C(C=O)n2c(Sc3ccccc13)ccc2C=O |c:8|
CN1CCN(CC1)C1=Cn2cccc2Sc2ccc(F)cc12 |t:8|
CN1CCN(CC1)[C@@H]1Cc2ccccc2Sc2ccc(Cl)cc12
CN1CCN(CC1)C1=Cn2cccc2Sc2ccc(Cl)cc12 |t:8|
CN1CCN(CC1)C1=Cn2c(Sc3ccccc13)ccc2C=O |t:8|
CC(C)OCc1ccc2Sc3ccccc3C(=Cn12)N1CCN(C)CC1 |c:17|
CN1CCN(CC1)C1=Cn2c(C)ccc2Sc2ccccc12 |t:8|
CN1CCN(CC1)[C@H]1Cc2ccccc2Sc2ccc(Cl)cc12
CN1CCN(CC1)C1=Cn2c(CN=O)ccc2Sc2ccccc12 |t:8|
COCc1ccc2Sc3ccc(Cl)cc3C(Cn12)N1CCN(C)CC1
Fc1ccc(cc1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
Fc1ccc(cc1)N1CCN(CC1)C1CC[Si](C1)(c1ccc(F)cc1)c1ccc(F)cc1
Fc1ccc(cc1)C1=CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1 |t:8|
C1C[Si](CC1N1CCN(CC1)c1ccccn1)(c1ccccc1)c1ccccc1
Clc1ccc(cc1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
Oc1ccc(cc1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
Cc1cccc(c1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
Fc1cccc(c1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
C1C[Si](CC1N1CCC(CC1)c1ccccc1)(c1ccccc1)c1ccccc1
Cc1ccc(cc1)N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
C1C[Si](CC1N1CCN(CC1)c1ccccc1)(c1ccccc1)c1ccccc1
C1C[Si](CC1N1CCN(CC1)c1ncccn1)(c1ccccc1)c1ccccc1
Fc1ccccc1N1CCN(CC1)C1CC[Si](C1)(c1ccccc1)c1ccccc1
CN1CCc2cc(Cl)c(O)cc2C(C1)c1cccc(Br)c1
CN1CCc2cc(Cl)c(O)cc2C(C1)c1ccccc1C(=O)C1=CC=C[C@@H]1[Re](C=O)(C=O)C=O |c:27,t:25|
CN1CCc2cc(Cl)c(O)cc2C(C1)c1ccccc1Br
CN1CCc2cc(Cl)c(O)cc2C(C1)c1cccc(c1)C(=O)C1=CC=C[C@@H]1[Re](C=O)(C=O)C=O |c:27,t:25|
CCCNC(C)Cc1cc(OC)c(Br)cc1OC
CN[C@H](C)Cc1ccc2OCOc2c1 |r|
C[C@H](N)Cn1ncc2ccc3OCCCc3c12 |r|
O\N=C/c1cnn2ccc(NC(=O)CCCN3CCN(CC3)c3cccc(Cl)c3Cl)cc12
CCCN(CCCCOc1ccn2nccc2c1)[C@@H]1CCc2c(O)cccc2C1 |r|
Clc1cccc(N2CCN(CCCC(=O)Nc3ccn4ncc(C#N)c4c3)CC2)c1Cl
COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3ncc(C#N)c3c2)CC1
Clc1cccc(N2CCN(CCCC(=O)Nc3ccn4ncc(C=O)c4c3)CC2)c1Cl
COc1ccccc1N1CCN(CCCCOc2ccn3ncc(C#N)c3c2)CC1
COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3ncc(C=O)c3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccc3ccnn3c2)CC1
CCCN(CCCCOc1ccc2ccnn2c1)[C@@H]1CCc2c(O)cccc2C1 |r|
COc1ccccc1N1CCN(CCCCOc2ccn3nc(\C=N\O)cc3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccn3ncc(\C=N\O)c3c2)CC1
Clc1cccc(N2CCN(CCCC(=O)Nc3ccn4nccc4c3)CC2)c1Cl
COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3nccc3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccc3c(\C=N\O)cnn3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccn3ncc(C=O)c3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccn3nccc3c2)CC1
CCCN(CCCCOc1ccn2ncc(C=O)c2c1)[C@H]1CCc2c(O)cccc2C1 |r|
COc1ccccc1N1CCN(CCCCOc2ccn3nc(cc3c2)C#N)CC1
CCCN(CCCCOc1ccn2ncc(\C=N/O)c2c1)[C@H]1CCc2c(O)cccc2C1 |r|
COc1ccccc1N1CCN(CCCCOc2ccc3c(C=O)cnn3c2)CC1
COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3ncc(\C=N/O)c3c2)CC1
CCCN(CCCCOc1ccc2ccnn2c1)[C@H]1CCc2c(O)cccc2C1 |r|
CCCN(CCCCOc1ccn2nccc2c1)[C@H]1CCc2c(O)cccc2C1 |r|
CCCN(CCCCOc1ccc2c(\C=N\O)cnn2c1)[C@H]1CCc2c(O)cccc2C1 |r|
COc1ccccc1N1CCN(CCCCOc2ccn3nc(C=O)cc3c2)CC1
COc1ccccc1N1CCN(CCCCOc2ccn3nc(CO)cc3c2)CC1
CCCN(CCCCOc1ccc2c(C=O)cnn2c1)[C@H]1CCc2c(O)cccc2C1 |r|
CCOC(=O)c1cc2cc(OCCCCN3CCN(CC3)c3ccccc3OC)ccn2n1
C#Cc1c[nH]c(CN2CCN(CC2)c2ccccc2)c1
C(N1CCN(CC1)c1ccccc1)c1cc(c[nH]1)-c1ccccc1
N#Cc1c[nH]c(CN2CCN(CC2)c2ccccc2)c1
CCn1nc(cc1-c1nccn1C)-c1cccc2ccccc12
CN(CCc1cccnc1)C(=O)c1sc(nc1C)-c1cccc2ccccc12
O=C(N1CCOCC1)c1nc(cs1)-c1cccc2ccccc12
Cc1sc(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Cc1nc(sc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Cc1nc(sc1C(N)=O)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1cccc2cnccc12
Clc1cccc(-c2nc(cs2)C(=O)N2CCCOCC2)c1Cl
COCCN(C)C(=O)c1sc(nc1C)-c1cccc2ccccc12
Cc1nn(nc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Cc1cn(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
CN(C)C(=O)c1sc(nc1C)-c1cccc2ccccc12
Cc1nc(sc1C(=O)N1CCC(O)CC1)-c1cccc2ccccc12
Cc1nc(sc1C(=O)N1CCCCC1)-c1cccc2ccccc12
Clc1ccc(-c2nc(cs2)C(=O)N2CCOCC2)c(Cl)c1
Cn1cc(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Cc1sc(nc1C(=O)N1CCOCC1)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1cccc2ncccc12
CCn1nc(cc1-c1ccnn1C)-c1cccc2ccccc12
CN1CCN(CC1)C(=O)c1sc(nc1C)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1cccc2ccccc12
OC1CCN(CC1)C(=O)c1csc(n1)-c1cccc(Cl)c1Cl
CCn1nc(cc1-c1ccc(N)nn1)-c1cccc2ccncc12
O=C(N1CCOCC1)c1csc(n1)-c1cccnc1
CCn1nc(cc1-c1cccnn1)-c1cncc2ccccc12
Cc1nc(-c2cccc3ccccc23)n(C)c1C(=O)N1CCC(CO)CC1
Cc1oc(nc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
O=C(N1CCOCC1)c1cnc(s1)-c1cccc2ccccc12
Fc1cccc(-c2nc(cs2)C(=O)N2CCOCC2)c1Cl
Cc1nc(sc1C(=O)N1CCOCC1)-c1cccc(Cl)c1Cl
Cc1cc(sc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Clc1ccccc1-c1nc(cs1)C(=O)N1CCOCC1
Cc1cc(oc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
CCn1nc(cc1-c1cncn1C)-c1cccc2ccccc12
Clc1cccc(-c2nc(cs2)C(=O)N2CCCCC2)c1Cl
OCC1CCN(CC1)C(=O)c1nnn(n1)-c1cccc2ccccc12
Cc1nc(sc1C(=O)N1CCc2[nH]cnc2C1)-c1cccc2ccccc12
CCn1nc(cc1-c1ccccn1)-c1cccc2ccccc12
CN(Cc1cccnc1)C(=O)c1sc(nc1C)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1ccnc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1cccc2ccncc12
Cc1nn(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
CCn1nc(cc1-c1ncccn1)-c1cccc2ccccc12
Cc1cccc(-c2nc(cs2)C(=O)N2CCOCC2)c1C
Cc1nc(sc1C(=O)N1CCCC(O)CC1)-c1cccc2ccccc12
Cc1nc(oc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
CC(C)N(CCO)C(=O)c1sc(nc1C)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1cccc2cccnc12
Clc1cccc(-c2csc(n2)C(=O)N2CCOCC2)c1Cl
Cc1nc(sc1C(=O)N1CCOCC1)-c1cccc2ccccc12
Cn1nc(cc1-c1cccnn1)-c1cccc2ccccc12
COCCNC(=O)c1sc(nc1C)-c1cccc2ccccc12
Cn1nc(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Cn1ccnc1-c1cc(nn1C)-c1cccc2ccccc12
CCn1nc(cc1-c1ncnn1C)-c1cccc2ccccc12
Cc1[nH]c(cc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
Clc1cccc(-c2nc(cs2)C(=O)N2CC3CC2CO3)c1Cl
CN(CCO)C(=O)c1sc(nc1C)-c1cccc2ccccc12
O=C(N1CCOCC1)c1csc(n1)-c1cccc2ccccc12
CCn1nc(cc1-c1cccnn1)-c1nccc2ccccc12
CCn1nc(cc1-c1ccc(N)nn1)-c1cccc2cccnc12
Cc1nc(sc1C(=O)N1CCNCC1)-c1cccc2ccccc12
Cn1cc(nc1C(=O)N1CCC(CO)CC1)-c1cccc2ccccc12
CN(Cc1ccn(C)n1)C(=O)c1sc(nc1C)-c1cccc2ccccc12
Cc1sc(nc1C(=O)N1CCOCC1)-c1cccc(Cl)c1Cl
Clc1cccc(-c2ncc(s2)C(=O)N2CCOCC2)c1Cl
Clc1cccc(-c2nc(cs2)C(=O)N2CCOCC2)c1Cl
Fc1c(Cl)cccc1-c1nc(cs1)C(=O)N1CCOCC1
COc1ccsc1CNCC1CC1c1cc(F)ccc1OC
COc1ccc(F)cc1C1CC1CNCc1cccnc1OC
COc1ccccc1CNC[C@H]1C[C@@H]1c1cc(F)ccc1OCC=C
COc1ccccc1CNC[C@@H]1C[C@H]1c1cc(F)ccc1OC
COc1ccc(F)cc1[C@@H]1C[C@H]1CNCc1cccs1
COc1ccc(F)cc1[C@H]1C[C@@H]1CNCc1cccs1
COc1sccc1CNCC1CC1c1cc(F)ccc1OC
CNC[C@H]1C[C@@H]1c1cc(F)ccc1OCC=C
COc1ccccc1C(C)NCC1CC1c1cc(F)ccc1OC
COc1ccc(F)cc1C1CC1CNC1CC1
COc1ccccc1CNC[C@H]1C[C@@H]1c1cc(F)ccc1OC
COc1cccc(CNC[C@H]2C[C@@H]2c2cc(F)ccc2OC)c1
COc1ccc(F)cc1C1CC1CNCc1ccccc1O
COc1ccc(F)cc1C1CC1CNCc1ccccc1OCCF
COc1ccc(F)cc1C1CC1CNCc1ccccc1C(N)=O
COc1ccc(F)cc1[C@@H]1C[C@H]1CNCc1ccccc1F
COc1ccc(F)cc1[C@H]1C[C@@H]1CNCc1ccccc1F
COc1ccc(F)cc1[C@H]1C[C@@H]1CNCc1ccccc1Cl
COc1ccccc1CN(C)CC1CC1c1cc(F)ccc1OC
COc1ccc(F)cc1C1CC1CNC1(CC1)c1ccccc1OC
COc1ccc(F)cc1C1CC1CNCc1cccc2cccnc12
COc1ccccc1CNC[C@H]1C[C@@H]1c1cc(F)ccc1OCCF
CNC[C@H]1C[C@@H]1c1cc(F)ccc1OC
COc1cccc(CNC[C@@H]2C[C@H]2c2cc(F)ccc2OC)c1
COc1ccc(F)cc1C1CC1CNCc1cccc2ccsc12
COc1cscc1CNCC1CC1c1cc(F)ccc1OC
COc1ccccc1CCNCC1CC1c1cc(F)ccc1OC
COc1ccc(F)cc1C1CC1CNCC1CC1
COc1ccc(F)cc1C1CC1CNCc1ccccc1C#N
COc1ccc(F)cc1[C@@H]1C[C@H]1CNCc1ccccc1Cl
Oc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2ccc(=O)oc12
Oc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2OCC(=O)Nc12
Oc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2OCCOc12
Oc1ccc(N2CCCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2ccc(=O)[nH]c12
Oc1ccc(N2CCCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2ccc(=O)oc12
Oc1ccc(N2CCCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2OCC(=O)Nc12
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2ccc(=O)oc12
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2OCC(=O)Nc12
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2cccnc12
Oc1ccc(N2CCCN(CCCCOc3ccn4nccc4c3)CC2)c2ccc(=O)[nH]c12
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCN2CCCN(CC2)c2ccc(O)c3[nH]c(=O)ccc23)nn1
Oc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2cccnc12
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2ccc(=O)[nH]c12
Oc1ccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c2OCCOc12
CCCCn1cc(CCCOc2ccc(cc2OC)C(=O)NCCCCN2CCCN(CC2)c2ccc(O)c3[nH]c(=O)ccc23)nn1
Oc1ccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c2ccc(=O)[nH]c12
Cc1nc[nH]c1Cc1nc(cs1)-c1ccccc1
CCCN(CCCCN1CCCCC1)C1COc2cccc(OC)c2C1
CCCN(CCN1C(=O)c2ccccc2C1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)C1COc2cccc(OC)c2C1
CCCN(CCC)C1COc2ccccc2C1
CCCN(CCCON1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
COc1cccc2OCC(Cc12)NCCCCN1C(=O)CC2(CCCC2)CC1=O
COc1cccc2OCC(Cc12)N1CCCC1
CCCN(CCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCN1CC2CCCC2C1=O)C1COc2cccc(OC)c2C1
CCCN(CCC)C1COc2cccc(O)c2C1
CCCN(CCCNS(=O)(=O)c1ccc(C)cc1)C1COc2cccc(OC)c2C1
CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(O)c2C1
O=C1N(CCCCN2CCN(CC2)c2ncccn2)S(=O)(=O)c2ccccc12
CCCN(CCCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
CCC[N+](C)(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCNC(=O)c1ccc(F)cc1)C1COc2cccc(OC)c2C1
CCCN(CCCCN1C(=O)c2ccccc2C1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCn1c2ncccc2oc1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCN1CCOCC1)C1COc2cccc(OC)c2C1
CCCN(CCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCNC(=O)c1ccccc1OC)C1COc2cccc(OC)c2C1
CCCN(CCCN1C(=O)c2ccccc2C1=O)C1COc2cccc(OC)c2C1
CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2ccccc2C1
CCCN(CCNC(C)=O)C1COc2cccc(OC)c2C1
COc1cccc2OCC(Cc12)NCCCCN1C(=O)c2ccccc2C1=O
CCCN(CCCCN1C(=O)c2ccccc2S1(=O)=O)C1COc2cccc(OC)c2C1
CCCN(CCC)C1COc2ccc3ccccc3c2C1
C(CCc1c[nH]c2ccccc12)CN1CCC(CC1)c1ccccc1
C(CCc1c[nH]c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Fc1ccc(cc1)C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Fc1ccc(cc1)C1=CCN(CCCCc2c[nH]c3ccccc23)CC1 |t:8|
COc1ccccc1N1CCN(CCCCc2c[nH]c3ccccc23)CC1
COc1ccccc1C1CCN(CCCCc2c[nH]c3ccccc23)CC1
C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Fc1ccc(cc1)C1=CC2CCC(C1)N2CCCCc1cn(-c2ccc(F)cc2)c2ccccc12 |t:8|
Fc1ccc(cc1)N1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Fc1ccc(cc1)C1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Fc1ccc(cc1)C(=O)CC1CCN(CC2CC2)CC1
Fc1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccccc23)CC1
CCN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
CN(C)CCSc1nc2ccccc2c-2c1CCOc1ccccc-21
CN(C)CCSc1nc2ccccc2c2c1ccc1ccccc21
CCN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
CCN1CCN(CC1)c1nc2ccccc2c2c1cc(OC)c1ccccc21
CN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21
CN(C)CCSc1nc2ccccc2c-2c1COc1ccccc-21
C1CN(CCN1)c1nc2ccccc2c2c1ccc1ccccc21
CCN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
CN1CCN(CC1)c1nc2ccccc2c-2c1CCOc1ccccc-21
COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCNCC1
CN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCN(C)CC1
C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
CCN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21
C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
C1CN(CCN1)c1nc2ccccc2c-2c1CCc1ccccc-21
CN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
CN(C)CCSc1nc2ccccc2c-2c1CCc1ccccc-21
C1CN(CCN1)c1nc2ccccc2c-2c1CCOc1ccccc-21
CN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
Oc1cc2CC[C@H]3NCc4ccccc4[C@@H]3c2cc1O
C=CCN1CCC(=CC1)C1=Cc2ccccc2Oc2ccccc12 |c:6,t:10|
[#6]-[#7]-1-[#6]-[#6]-[#6](=[#6]-[#6]-1)-[#6]-1=[#6]-c2ccccc2\[#6](=[#6](/[#6])-[#6])-c2ccc(Cl)cc-12 |c:4,t:8|
CCN1CCC(=CC1)C1=Cc2ccccc2Cc2ccccc12 |c:5,t:9|
CN1CCC(=CC1)C1=Cc2ccccc2Oc2ccccc12 |c:4,t:8|
CN1CCC(CC1)C1=Cc2ccccc2Oc2ccccc12 |t:8|
CCN1CCC(=CC1)C1=Cc2ccccc2Oc2ccccc12 |c:5,t:9|
CN1CCC(=CC1)C1=Cc2ccccc2Cc2ccccc12 |c:4,t:8|
C=CCN1CCC(=CC1)C1=Cc2ccccc2Cc2ccccc12 |c:6,t:10|
O=C(C1CCN(CCCCc2ccccc2)CC1)c1ccccc1
Fc1ccc(CC2CCN(CCCCc3ccccc3)CC2)cc1
C(CCc1ccccc1)CN1CCC(CC1)C(=C/Cc1ccccc1)\c1ccccc1
C(CCc1ccccc1)CN1CCC(CC1)C(=C\c1ccccc1)\c1ccccc1
Fc1ccc(cc1)C(=O)C1CCN(CCCCc2ccccc2)CC1
O=c1[nH]c2ccccc2c(=O)n1CCN1CCC(CC1)C(c1ccccc1)c1ccccc1
[#6](-[#6]-c1ccccc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccccc1)-c1ccccc1
O=C(N1CCN(CCCCc2ccccc2)CC1)c1ccccc1
[#6](-[#6]-[#6]-c1ccccc1)-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccccc1)-c1ccccc1
OC(C1CCN(CCCCc2ccccc2)CC1)c1ccc(F)cc1
O=C(C1CCN(CCc2ccccc2)CC1)c1ccccc1
C(CCc1ccccc1)CN1CCC(CC1)C(=C/CCc1ccccc1)\c1ccccc1
OC(C1CCN(CCc2ccccc2)CC1)c1ccc(F)cc1
CN1CCC(CC1)C(=O)c1ccccc1
CN1CCN(CC1)C(=C\c1ccccc1)\c1ccccc1
CN1CCC(CC1)C(=C\c1ccccc1)\c1ccccc1
C(CCc1ccccc1)CN1CCC(Cc2ccccc2)CC1
C(Cc1ccccc1)N1CCC(Cc2ccccc2)CC1
C(CCc1ccccc1)CN1CCN(CC1)C(=C\c1ccccc1)\c1ccccc1
Fc1ccc(CC2CCN(CCc3ccccc3)CC2)cc1
C(CCc1ccccc1)CN1CCN(Cc2ccccc2)CC1
C(Cc1ccccc1)N1CCC(CC1)C(=C/c1ccccc1)\c1ccccc1
OC(C1CCN(CCCCc2ccccc2)CC1)c1ccccc1
O=c1[nH]c2ccccc2c(=O)n1CCN1CCN(CC1)C(c1ccccc1)c1ccccc1
COc1cccc2C(CCCN3CCN(CC3)c3ccccc3OC)CCCc12
COc1ccc2C(CCCN3CCN(CC3)c3ccccc3)CCCc2c1
COc1ccc2CCC(CCN3CCN(CC3)c3ccccc3)=Cc2c1 |c:24|
COc1cccc2C(CCCN3CCN(CC3)c3ccccn3)CCCc12
COc1ccc2CCC=C(CCCN3CCN(CC3)c3ccccc3)c2c1 |t:8|
COc1cccc2CCCC(CCCN3CCN(CC3)c3ccccc3)c12
COc1cccc2C(CCN3CCN(CC3)c3ccccc3)CCCc12
COc1cccc2C(CCCN3CCN(CC3)c3ccccc3)CCCc12
COc1ccc2CCC(CCN3CCN(CC3)c3ccccc3)Cc2c1
COc1ccc2C=C(CCN3CCN(CC3)c3ccccc3)CCc2c1 |t:6|
COc1cccc2C(CCCN3CCN(CC3)c3ccccc3)=CCCc12 |c:24|
COc1cccc2\C(CCCc12)=C\CCN1CCN(CC1)c1ccccc1
COc1cccc2CC(CCN3CCN(CC3)c3ccccc3)CCc12
COc1ccc2CC(CCN3CCN(CC3)c3ccccc3)CCc2c1
COc1cccc2C(CCCCN3CCN(CC3)c3ccccc3)CCCc12
COc1cccc2C=C(CCN3CCN(CC3)c3ccccc3)CCc12 |t:7|
Cc1coc(CNc2nc(N)nc3ccn(Cc4ccccn4)c23)n1
Cc1cc(CNc2nc(N)nc3ccn(Cc4ccccn4)c23)no1
Oc1cc2CC[C@@H]3NCc4ccsc4[C@H]3c2cc1O
Cc1cnc(CNc2nc(N)nc3ccn(Cc4ccccn4)c23)o1
CN1CCN(CC1)c1nc2ccccc2n2cccc12
Fc1cccc2nc(N3CCNCC3)c3cccn3c12
Fc1ccc2c(c1)nc(N1CCNCC1)c1cccn21
C(Oc1cccc2C=C(CN3CCOCC3)COc12)[C@H]1CNCCO1 |r,t:7|
C(Oc1cccc2C=C(CN3CCOCC3)COc12)[C@@H]1CNCCO1 |r,t:7|
CN1CCN(CC1)c1ccc2Cc3ccccc3-c2n1
CN1CCN(CC1)c1nc2ccccc2c2C3CCC(C3)Cc12
CN1CCN(CC1)c1nc2ccccc2c2CCCCc12
CN1CCN(CC1)c1nc2ccccc2c2-c3ccsc3CCc12
CN1CCN(CC1)c1nc2ccccc2c(-c2ccccc2)c1COC(=O)c1ccccc1
CN1CCN(CC1)c1cc2-c3ccccc3-c3cccc(n1)c23
O=S(=O)(N1CCC(CCN2CCN(CC2)c2ccccc2)CC1)c1cccc2ncccc12
O=S(=O)(N1CCC(CCN2CCN(CC2)c2ccccc2)CC1)c1cncc2ccccc12
Fc1ccc(cc1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
Fc1ccc(cc1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
Clc1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
Fc1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
Fc1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
Clc1cccc(N2CCN(CCC3CCN(CC3)S(=O)(=O)c3cccc4ncccc34)CC2)c1Cl
Clc1cccc(N2CCN(CCC3CCN(CC3)S(=O)(=O)c3cncc4ccccc34)CC2)c1Cl
Clc1ccc(cc1Cl)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cncc3ccccc23)CC1
Clc1ccc(cc1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
Clc1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
Clc1ccc(cc1Cl)N1CCN(CCC2CCN(CC2)S(=O)(=O)c2cccc3ncccc23)CC1
CC1(CC(=O)N(C(=O)C1)CCCCN2CCN(CC2)c3ncccn3)C
CCS(=O)(=O)Nc1cccc(c1)N1CCN(CCCCn2c(O)c3CCCn3c2=O)CC1
CCOc1ccc(CCOC(=O)N2CCN(CCCc3ccccc3)CC2)cc1
Fc1ccc(CCC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1
Fc1ccc(cc1)C(CCCN1CCN(CC1)C(=O)CCCc1ccccc1)c1ccc(F)cc1
Fc1ccc(CCOC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1
CCOc1ccc(CCNC(=O)N2CCN(CCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1
Fc1ccc(cc1)C(CCCN1CCN(CC1)C(=O)OCCc1ccc(cc1)C#N)c1ccc(F)cc1
O=C(OCCc1ccc(cc1)C#N)N1CCN(CCCc2ccccc2)CC1
Fc1ccc(cc1)C(CCCN1CCC(CC1)NC(=O)OCCc1ccc(cc1)C#N)c1ccc(F)cc1
CN(C)CCc1c(C)[nH]c2cccc(NC(=O)c3ccc(F)cc3)c12
OCCN1CCN(CC1)C1Cn2cccc2Sc2ccc(F)cc12
CCN1CCN(CC1)C1Cn2cccc2Sc2ccc(Cl)cc12
CCN1CCN(CC1)C1Cn2cccc2Sc2ccc(Br)cc12
CN1CCN(CC1)C1Cn2cccc2Sc2ccc(Cl)cc12
OCCN1CCN(CC1)C1Cn2cccc2Sc2ccc(Br)cc12
CN1CCN(CC1)C1Cn2cccc2Sc2ccc(F)cc12
CN1CCN(CC1)C1Cc2ccccc2Sc2ccc(Cl)cc12
CN1CCN(CC1)C1Cn2cccc2Sc2ccccc12
CN1CCN(CC1)C1Cn2cccc2Sc2ccc(Br)cc12
OCCN1CCN(CC1)C1Cn2cccc2Sc2ccc(Cl)cc12
CCN1CCN(CC1)C1Cn2cccc2Sc2ccc(F)cc12
CN1CCCN(CC1)C1Cn2cccc2Sc2ccc(Cl)cc12
COc1ccc2OC3(CCN(CCN4CCNC4=O)CC3)CCc2c1
COc1ccc2OC3(CCN(CCCC(=O)c4ccc(F)cc4)CC3)CCc2c1
Fc1ccc(CCN2CCC(CC2)S(=O)(=O)c2ccc(Cl)cc2)c(F)c1
O=S(=O)(C1CCN(Cc2ccccc2)CC1)c1ccccc1
Fc1ccc(CCN2CCC3(CC2)CCc2c(F)cccc2O3)c(F)c1
OC(CCc1ccccc1)CN1CCC2(CC1)CCc1cc(F)ccc1O2
Fc1ccc(CCN2CCC(CC2)S(=O)(=O)c2ccccc2C#N)c(F)c1
O=C1NCCN1CCN1CCC(CC1)S(=O)(=O)c1ccccc1
COc1ccc2OC3(CCN(CCc4ccc(F)cc4F)CC3)CCc2c1
Fc1ccc(CCN2CCC3(CC2)CCc2cccc(F)c2O3)c(F)c1
Fc1ccc(CCN2CCC3(CC2)CCc2ccccc2S3(=O)=O)c(F)c1
Fc1ccc(cc1)C(=O)CN1CCC(CC1)S(=O)(=O)c1ccccc1
NC(=O)c1ccc(cc1)S(=O)(=O)C1CCN(CCc2ccc(F)cc2F)CC1
Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)S(=O)(=O)c1ccccc1
OC1c2ccccc2CCC11CCN(CCc2ccccc2)CC1
Fc1ccc(CCN2CCC3(CC2)Oc2ccc(F)cc2C=C3)c(F)c1 |c:23|
O=S(=O)(C1CCN(CCCc2ccccc2)CC1)c1ccccc1
Fc1ccc(CCN2CCC3(CC2)CCc2ccccc2O3)c(F)c1
Fc1ccc(CCN2CCC3(CC2)CCc2ccc(F)cc2O3)c(F)c1
Clc1ccc2C(=O)C3(CCN(CCc4ccccc4)CC3)CCc2c1
Fc1ccc2OC3(CCN(CC3)C3CCc4ccccc4C3)CCc2c1
Fc1ccc(CCN2CCC3(CC2)CC(=O)c2cc(ccc2O3)C#N)c(F)c1
Fc1ccc(CCN2CCC(CC2)S(=O)(=O)c2ccc(cc2)C#N)c(F)c1
Fc1ccc(CCN2CCC(CC2)S(=O)(=O)c2cccc(c2)C#N)c(F)c1
C(Cc1ccccc1)N1CCC2(CC1)CCc1ccccc1O2
Fc1ccc(CCN2CCC3(CC2)CCc2ccccc2C3)c(F)c1
NC(=O)c1cccc(c1)S(=O)(=O)C1CCN(CCc2ccc(F)cc2F)CC1
O=S(=O)(C1CCN(CCc2ccccc2)CC1)c1ccccc1
COc1cccc(c1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
COc1ccc(cc1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
Fc1ccc(cc1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
C(N1CCN(CC1)c1ccccn1)c1cn(c(n1)-c1ccccc1)-c1ccccc1
Fc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
C(N1CCN(Cc2ccccc2)CC1)c1cn(c(n1)-c1ccccc1)-c1ccccc1
COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Clc1cccc(c1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
C(N1CCN(CC1)c1ccccc1)c1cn(c(n1)-c1ccccc1)-c1ccccc1
Clc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
FC(F)(F)c1ccc(cc1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
Clc1ccc(cc1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
FC(F)(F)c1cccc(c1)N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
CN1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Fc1ccc(cc1)-c1nc(CN2CCN(CC2)c2ccccc2)cn1-c1ccc(F)cc1
COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccccc2)-c2ccccc2)CC1
Cc1ccc(cc1C)N1CCN(Cc2nc3ccccc3[nH]2)CC1
OCc1ccc(cc1Cl)N1CCN(Cc2nc3ccccc3[nH]2)CC1
CC(C)Oc1cccnc1N(C)C1CCN(Cc2ccc(I)cc2)CC1
Clc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
c1ccc2c(c1)CCO[C@H]2CCN3CCN(CC3)c4ccc(cc4)S(=O)(=O)N
CN1CCc2ccc3[C@@H](N)c4cccc5C[C@@H]1c2c3-c45
C[C@@H](N)Cc1c[nH]c2ccc3OCCCc3c12
Cn1cc(CCN)c2c3CCCOc3ccc12
CN(C)CCc1c[nH]c2ccc3OCCCc3c12
C[C@H](N)Cc1c[nH]c2ccc3OCCCc3c12
NCCc1c[nH]c2ccc3OCCCc3c12
CC(N)Cc1c[nH]c2ccc3OCCCc3c12
CC(N)Cc1cn(C)c2ccc3OCCCc3c12
C[C@H](CN1CCN(CC1)c1cc(F)c(F)cc1F)N1C(=O)CC2(CCCC2)CC1=O
COc1cc2c(cc1OC)nc(nc2N)N3CCN(CC3)C(=O)c4ccco4
Cn1nnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1ncccn1
Cn1cc(nn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1c[nH]nn1
Cn1ncnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1nncc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1ncc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCOC3=O)CC2)c2cc(ccc12)-c1ncccn1
Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCOC4=O)CC3)c2c1)-c1ccc(F)cc1
CN1CCC(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3ccc(cc23)-c2ncn(C)n2)C1=O
Cn1nnnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
CCn1ncc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
CCn1cc(nn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1cc(cn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1nnn[nH]1
Fc1ccc(cc1)-n1cc(C2CCN(CCC#N)CC2)c2cc(ccc12)-c1ncccn1
Cn1cnnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1cccnc1
Cn1nnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCOC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1nccc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1cncnc1
Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCn4c(=O)[nH]c5ccccc5c4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1ccc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCC#N)CC3)c2c1)-c1ccc(F)cc1
Brc1ccc(OC(C2CCNCC2)c2ccccc2)cc1
C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
c1ccc2c(c1)C3=NCCN3[C@]2(c4ccc(cc4)Cl)O
Fc1cccc(c1)C(Oc1ccccc1F)C1CCNCC1
COc1ccc(OC(CC2CCNCC2)c2ccccc2)cc1
Ic1ccc(OC(C2CCNCC2)c2ccccc2)cc1
Fc1ccccc1OC(CCN1CCN(CC1)c1noc2ccccc12)c1ccccc1
Fc1cc(F)cc(OC(C2CCNCC2)c2ccccc2)c1
FC(F)(F)c1ccccc1OC(C1CCNCC1)c1ccccc1
FC(F)(F)c1cccc(OC(C2CCNCC2)c2ccccc2)c1
COc1ccc(OC(CCN2CCN(CC2)c2noc3ccccc23)c2ccccc2)cc1
COc1ccc(OC(C2CCNCC2)c2ccc(F)cc2)cc1
COc1cc2CCN(CCC(Oc3ccc(C)cc3)c3ccccc3)Cc2cc1OC
Fc1ccc(OC(C2CCNCC2)c2ccccc2)cc1
COc1cc2CCN(CCC(Oc3ccc(Cl)cc3)c3ccccc3)Cc2cc1OC
[O-][N+](=O)c1ccc(OC(C2CCNCC2)c2ccccc2)cc1
Cc1c(Cl)cccc1OC(C1CCNCC1)c1ccccc1
Cc1ccc(OC(C2CCCNC2)c2ccc(F)cc2)cc1
CC(=O)N1CCC(CC1)C(Oc1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)C(Oc1cccc2ccccc12)C1CCCNC1
Fc1ccc(OC(C2CCNCC2)c2ccc(Cl)cc2)cc1
Clc1cc(OC(C2CCNCC2)c2ccccc2)ccc1C#N
C1CC(CCN1)C(Oc1ccccc1)c1ccccc1
Fc1ccccc1OC(C1CCNCC1)c1ccccc1
COc1ccc(OC(C2CCN(CC2)C(C)=O)c2ccc(F)cc2)cc1
Clc1ccc(OC(C2CCNCC2)c2ccccc2)cc1Cl
[O-][N+](=O)c1ccc(OC(CCN2CCN(CC2)c2n[o+][c-]3ccccc23)c2ccccc2)cc1
Fc1ccc(cc1)C(Oc1ccccc1)C1CCCNC1
N#Cc1cccc(OC(C2CCNCC2)c2ccccc2)c1
Fc1cccc(OC(C2CCNCC2)c2ccccc2)c1
Fc1ccc(cc1)C(Oc1ccc(Cl)c(Cl)c1)C1CCCNC1
Fc1ccc(OC(C2CCCNC2)c2ccc(F)cc2)cc1
FC(F)(F)c1ccc(OC(C2CCNCC2)c2ccccc2)cc1
Fc1cc(OC(C2CCNCC2)c2ccccc2)cc(c1)C#N
COc1cc2CCN(CCC(Oc3ccccc3F)c3ccccc3)Cc2cc1OC
Nc1ccc(OC(CCC(=O)C2CCN(CC2)c2ccc(F)cc2)c2ccccc2)cc1
Nc1ccc(OC(CCC(=O)C2CCN(CC2)c2ccc(F)cc2)c2ccc(F)cc2)cc1
[O-][N+](=O)c1ccc(OC(CCC(=O)C2CCN(CC2)c2ccc(F)cc2)c2ccccc2)cc1
Cc1ccc(OC(CCN2CCc3ccccc3C2)c2ccccc2)cc1
Oc1c(F)cccc1OC(C1CCNCC1)c1ccccc1
Fc1ccc(OC(C2CCNCC2)c2cccc(F)c2)cc1
COc1ccc(OC(C2CCCNC2)c2ccc(F)cc2)cc1
Fc1ccc(OC(C2CCNCC2)c2ccc(F)cc2)cc1
COc1cc(F)cc(OC(C2CCNCC2)c2ccccc2)c1
Fc1cccc(OC(C2CCNCC2)c2cccc(F)c2)c1
Fc1ccc(cc1)C(Oc1ccc(Cl)cc1)C1CCCNC1
Fc1cccc(OC(C2CCCC2)c2ccccc2)c1
Clc1ccc(cc1)C(Oc1ccccc1)C1CCNCC1
Brc1cccc(OC(C2CCNCC2)c2ccccc2)c1
Clc1cccc(OC(C2CCNCC2)c2ccccc2)c1
Cc1c(F)cccc1OC(C1CCNCC1)c1ccccc1
Clc1ccccc1OC(C1CCNCC1)c1ccccc1
Fc1ccc(cc1)C(Oc1ccc(cc1)C(F)(F)F)C1CCCNC1
N#Cc1ccccc1OC(C1CCNCC1)c1ccccc1
Cc1ccc(OC(CCN2CCc3cc(O)c(O)cc3C2)c2ccccc2)cc1
Fc1ccc(cc1)N1CCC(CC1)C(=O)CCC(Oc1ccccc1F)c1ccccc1
Ic1cccc(OC(C2CCNCC2)c2ccccc2)c1
C1CC(CCN1)C(Oc1ccccc1-c1ccccc1)c1ccccc1
FC(F)(F)c1cccc(OC(CCN2CCN(CC2)c2nsc3ccccc23)c2ccccc2)c1
Cc1ccc(Cl)cc1OC(C1CCNCC1)c1ccccc1
Cc1ccc(cc1)C(Oc1cccc(F)c1)C1CCNCC1
Fc1ccc(cc1)C(CC1CCNCC1)Oc1ccc(cc1)C#N
Oc1cc2CCN(CCC(Oc3ccccc3C(F)(F)F)c3ccccc3)Cc2cc1O
COc1cc2CCN(CCC(Oc3ccccc3C(F)(F)F)c3ccccc3)Cc2cc1OC
Fc1ccccc1OC(CCN1CCN(CC1)c1nsc2ccccc12)c1ccccc1
Fc1ccc(cc1)C(Oc1ccc2OCOc2c1)C1CCCNC1
Oc1cc2CCN(CCC(Oc3ccccc3F)c3ccccc3)Cc2cc1O
CN1CCC(CC1)C(Oc1ccc(F)cc1)c1ccccc1
Fc1cccc(OC(C2CCOCC2)c2ccccc2)c1
[O-][N+](=O)c1ccc(OC(CCC(=O)C2CCN(CC2)c2ccc(F)cc2)c2ccc(F)cc2)cc1
FC(F)(F)c1ccccc1OC(CCN1CCN(CC1)c1nsc2ccccc12)c1ccccc1
COc1ccc(OC(CCN2CCN(CC2)c2nsc3ccccc23)c2ccccc2)cc1
COc1ccc(OC(CCC(=O)C2CCN(CC2)c2ccc(F)cc2)c2ccccc2)cc1
Oc1cc2CCN(CCC(Oc3ccc(Cl)cc3)c3ccccc3)Cc2cc1O
Fc1ccccc1OC(CCN1CCc2ccccc2C1)c1ccccc1
FC(F)(F)c1ccccc1OC(CCN1CCc2ccccc2C1)c1ccccc1
C1CC(CCN1)C(Oc1ccc(cc1)-c1ccccc1)c1ccccc1
Fc1ccc(OC(CC2CCNCC2)c2ccccc2)cc1
Fc1ccc(cc1)C(Oc1ccc(cc1)C#N)C1CCCNC1
Clc1ccc(OC(CCN2CCc3ccccc3C2)c2ccccc2)cc1
CCOc1ccccc1OC(C1CNCCO1)c1ccccc1
Oc1ccc(OC(C2CCNCC2)c2ccccc2)cc1F
FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2nsc3ccccc23)c2ccccc2)cc1
Fc1ccc(OC(CC2CCNCC2)c2ccc(F)cc2)cc1
Oc1cc(F)cc(OC(C2CCNCC2)c2ccccc2)c1
c1cc(cc(c1)Cl)CCNCCc2ccc3ccc(nc3c2)N
CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O |r,@:1|
CN1CCCC1Cc1c[nH]c2ccc(NS(=O)(=O)c3ccccc3Cl)cc12
CN1CCCC1Cc1c[nH]c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc12
C1CN(CCN1)c1cccc2ccccc12
O=C1Cc2cc(CCN3CCN(CC3)c3cccc4ccccc34)ccc2N1
C[C@@H]1CN(Cc2ccc(F)cc2)CCN1C(=O)\C=C\c1ccc(Cl)cc1NC(C)=O
Cc1nc2C(F)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1nc2C(Cl)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1nc2n(CCCC2(F)F)c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1nc2n(CCCC2(C)O)c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1noc2cc(F)ccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2scnc12
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)c1nccc2sccc12
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)c1ncnc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1ncnc2sccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1cccc2OC(F)(F)Oc12
Cc1ccc(Sc2ccccc2N2CCN(CCc3c(C)nc4C(O)CCCn4c3=O)CC2)c(C)c1
Cc1nc2C(Cl)CCCn2c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Cc1nc2C(=O)CCCn2c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Cc1nc2n(CCCC2(F)F)c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1
O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1
FC(F)(F)Oc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1
FC(F)(F)Oc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1
Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1
FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1
Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1F
Cc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1
FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1
Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1Cl
COc1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1
O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1
Cc1nc2C(=O)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1csc2ccsc12
Cc1nc2C(O)CCCn2c(=O)c1CCN1CCN(CC1)c1nccc2sccc12
Cc1nc2CCCCn2c(=O)c1CCN1CCN(CC1)c1cccc2OC(F)(F)Oc12
Cc1nc2C(F)CCCn2c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Cc1nc2n(CCCC2(C)O)c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Cc1nc2n(CCCC2(C)O)c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Cc1nc2ccccn2c(=O)c1CCN1CCN(CC1)c1cccc2sccc12
Clc1ccc(cc1)N1CCN(Cc2cn3ccccc3n2)CC1
Clc1ccc(cc1Cl)N1CCN(Cc2cn3ccccc3n2)CC1
Clc1ccc(cc1)N1CCN(Cc2cn3nc(Cl)ccc3n2)CC1
Fc1ccc(cc1)N1CCN(Cc2cn3ccccc3n2)CC1
COc1ccccc1N1CCN(Cc2cn3nc(Cl)ccc3n2)CC1
COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Clc1ccc2nc(CN3CCN(CC3)c3ccc(Cl)c(Cl)c3)cn2n1
Clc1ccc(cc1)N1CCN(Cc2cnn3ccccc23)CC1
O\N=C\c1cnn2ccc(OCCCCN3CCN(CC3)c3ccc(O)c4OCCOc34)cc12
O\N=C\c1cnn2ccc(OCCCCN3CCN(CC3)c3ccc(O)c4NC(=O)COc34)cc12
O\N=C\c1cnn2ccc(OCCCCN3CCN(CC3)c3ccc(O)c4[nH]c(=O)ccc34)cc12
Oc1ccc(N2CCN(CCCCOc3ccn4ncc(C=O)c4c3)CC2)c2ccc(=O)[nH]c12
Oc1ccc(N2CCN(CCCCOc3ccn4ncc(C=O)c4c3)CC2)c2OCCOc12
Oc1ccc(N2CCNCC2)c2ccc(=O)[nH]c12
Oc1ccc(N2CCNCC2)c2OCC(=O)Nc12
Oc1ccc(N2CCCNCC2)c2OCC(=O)Nc12
CN1CCN(CC1)c1ccc(O)c2[nH]c(=O)ccc12
CN1CCN(CC1)c1ccc(O)c2NC(=O)COc12
CN1CCN(CC1)c1ccc(O)c2OCCOc12
CCCN1CCN(CC1)c1ccc(O)c2[nH]c(=O)ccc12
CCCN1CCN(CC1)c1ccc(O)c2NC(=O)COc12
CCCN1CCN(CC1)c1ccc(O)c2OCCOc12
Oc1ccc(N2CCN(CCCCOc3ccn4ncc(C=O)c4c3)CC2)c2OCC(=O)Nc12
Oc1ccc(N2CCNCC2)c2OCCOc12
CN1CCCN(CC1)c1ccc(O)c2NC(=O)COc12
CCCN1CCCN(CC1)c1ccc(O)c2NC(=O)COc12
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1ccccc1OC
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1cccc(Cl)c1
Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCc2ccccc2C1
Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCc2ccccc2C1
Cn1c2[nH]c(=O)n(CCCN3CCc4ccccc4C3)c2c(=O)n(C)c1=O
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1ccccc1
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1cccc(Cl)c1
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1ccccc1OC
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1ccccc1
Cn1c2[nH]c(=O)n(CCCCN3CCN(CC3)c3cccc(Cl)c3)c2c(=O)n(C)c1=O
Cn1c2[nH]c(=O)n(CCCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1cccc(Cl)c1
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCc2ccccc2C1
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1cccc(Cl)c1
CCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCCN1CCN(CC1)c1ccccc1
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1ccccc1OC
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCc2ccccc2C1
CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCN1CCN(CC1)c1ccccc1
Cc1cc(F)ccc1\C=C\c1ccc(cn1)S(=O)(=O)c1ccccc1F
Fc1ccc(\C=C\c2ccc(nc2)S(=O)(=O)c2ccc(F)cc2)cc1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)c2ccccc2)cc1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2F)cc1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccc(F)cc2)cc1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2F)c(c1)C#N
COc1cc(F)ccc1\C=C\c1ccc(cn1)S(=O)(=O)c1ccccc1F
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2F)c(F)c1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2F)c(Cl)c1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2)cc1
Oc1ccccc1\C=C\c1ccc(cn1)S(=O)(=O)c1ccccc1F
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2cccc(F)c2)cc1
Oc1cc(F)ccc1\C=C\c1ccc(cn1)S(=O)(=O)c1ccccc1F
Fc1ccc(\C=C\c2ccc(cn2)S(=O)c2ccccc2)c(F)c1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)c2ccccc2F)c(F)c1
Fc1ccc(CCc2ccc(cn2)S(=O)(=O)c2ccc(F)cc2)cc1
Fc1ccc(CCc2ccc(nc2)S(=O)(=O)c2ccc(F)cc2)cc1
Fc1ccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2)c(F)c1
Fc1cccc(\C=C\c2ccc(cn2)S(=O)(=O)c2ccccc2F)c1
Fc1ccccc1\C=C\c1ccc(cn1)S(=O)(=O)c1ccccc1F
Fc1ccc(\C=C\c2ccc(cn2)S(=O)c2ccccc2F)cc1
Fc1ccccc1S(=O)(=O)c1ccc(\C=C\c2ccncc2)nc1
COc1cc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)cc(OC)c1
NC1=Nc2cccc(Cl)c2CN1 |t:1|
NC1=Nc2ccc(Cl)c(Cl)c2CN1 |t:1|
CCN(CC)c1nc2CCNCc2c(n1)-c1ccc(C)cc1
Fc1ccc(cc1)-c1nc(nc2CCNCc12)C1CCCC1
Cc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CCNCCc12
N#Cc1ccc(cc1)-c1nc(nc2CCNCCc12)C1CCCC1
CC(C)c1nc2CCNCCc2c(n1)-c1ccc(F)cc1
Cc1nc2CCNCCc2c(n1)-c1ccc(Cl)cc1
Fc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CCCNCc12
Fc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CNCCc12
Fc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CNCCCc12
Fc1ccc(cc1)-c1nc(nc2CCNCc12)-c1ccccc1
CC(C)Cc1nc2CCNCc2c(n1)-c1ccc(F)cc1
Fc1ccc(cc1)-c1nc(nc2CCNCc12)C1CC1
Fc1ccc(cc1)-c1nc(nc2CCNCc12)C1CCC1
Fc1ccc(Cc2nc3CCNCc3c(n2)-c2ccc(F)cc2)cc1
CCC(C)c1nc2CCNCc2c(n1)-c1ccc(F)cc1 |w:2.2|
Cc1ccc(cc1)-c1nc(nc2CCNCCc12)C1CCCC1
Fc1ccc(cc1)-c1nc(nc2CCNCCc12)C1CCCC1
CC(C)(C)c1nc2CCNCc2c(n1)-c1ccc(F)cc1
Fc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CCNCc12
FC(F)(F)c1ccc(cc1)-c1nc(Cc2ccccc2)nc2CCNCCc12
Fc1ccc(cc1)-c1nc(Cc2ccccc2)nc2CCNCCc12
Fc1ccc(Cc2nc3CCNCCc3c(n2)-c2ccc(F)cc2)cc1
COc1ccc(cc1)-c1nc(nc2CCNCCc12)C1CCCC1
C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c12 |c:8|
C[C@@H]1NC(N)=Nc2cccc(Cl)c12 |c:4|
Brc1cccc(n1)N1CCN(Cc2cnn3ccccc23)CC1
Fc1cccc(n1)N1CCN(Cc2cnn3ccccc23)CC1
Clc1ccc(cc1)N1CCN(Cc2cc3ccccn3n2)CC1
Oc1ccccc1N1CCN(Cc2cnn3ccccc23)CC1
FCCOc1ccc(cc1)N1CCN(Cc2cc3ccccn3n2)CC1
FCCOc1ccc(cc1)N1CCN(Cc2cnn3ccccc23)CC1
FCCOc1ccccc1N1CCN(Cc2cnn3ccccc23)CC1
Fc1cccc(n1)N1CCN(Cc2cc3ccccn3n2)CC1
Oc1ccc(cc1)N1CCN(Cc2cnn3ccccc23)CC1
FCCOc1ccccc1N1CCN(Cc2cc3ccccn3n2)CC1
Brc1cccc(n1)N1CCN(Cc2cc3ccccn3n2)CC1
FCCOc1ccc(CN2CCN(CC2)c2ccc(Cl)cc2)cc1
COc1ccccc1N1CCN(Cc2cccc(OCCF)c2)CC1
COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF
COc1cc(CN2CCN(CC2)c2ccc(Cl)cc2)c(OCCF)cc1OC
FCCOc1cccc(CN2CCN(CC2)c2ccc(Cl)cc2)c1
COc1cc(CN2CCN(CC2)c2ccc(Cl)cc2)ccc1OCCF
COc1cc(CN2CCN(CC2)c2ccccc2OC)c(OCCF)cc1OC
COc1ccccc1N1CCN(Cc2ccc(OCCF)cc2)CC1
CCc1cc2c(ccc3c(OC)nn(C[C@H](C)N)c23)o1
CCc1cc2c(ccc3c(CC)nn(C[C@H](C)N)c23)o1
CCc1cc2c(ccc3c(C)nn(C[C@H](C)N)c23)o1
C[C@H](N)Cn1ncc2ccc3oc(cc3c12)C(C)C
CCc1cc2c(ccc3cnn(C[C@H](C)N)c23)o1
C[C@H](N)Cn1ncc2ccc3oc(C)cc3c12
COc1nn(C[C@H](C)N)c2c1ccc1occc21
CCCc1nn(C[C@H](C)N)c2c1ccc1occc21
CCc1nn(C[C@H](C)N)c2c1ccc1occc21
C[C@H](N)Cn1nc(C)c2ccc3occc3c12
C[C@H](N)Cn1ncc2ccc3ocnc3c12
C[C@H](N)Cn1ncc2ccc3occc3c12
C[C@H](N)Cn1ncc2ccc3sccc3c12
C[C@H](N)Cn1ncc2cc(Cl)c(Cl)cc12
COc1ccc2cnn(C[C@H](C)N)c2c1Cl
C[C@H](N)Cn1ncc2cc(F)ccc12
C[C@H](N)Cn1ncc2ccc(Cl)c(Cl)c12
C[C@H](N)Cn1ncc2ccc(F)cc12
CC(Oc1ccc(Cl)cc1C)C(O)=O
C1Cc2ccc3occc3c2CCN1
Clc1c(Br)ccc2CCNCCc12
Clc1c2CCNCCc2ccc1C#N
C1Cc2ccc3ccoc3c2CCN1
CNc1ccc2CCNCCc2c1Cl
COc1ccc2CCNCCc2c1Cl
Clc1ccc2CCNCCc2c1Cl
Fc1ccc2CCNCCc2c1Cl
[O-][N+](=O)c1ccc2CCNCCc2c1Cl
CN1CCc2ccc(c(Cl)c2CC1)[N+]([O-])=O
Cc1cccc(N2CCN(CCCC(=O)NCc3nc4ccccc4c(=O)n3-c3ccccc3)CC2)c1C
Cc1cccc(N2CCN(CCCC(=O)NCc3nc4cc(F)ccc4c(=O)n3-c3ccccc3)CC2)c1C
Fc1ccc2c(c1)nc(CNC(=O)CCCN1CCN(CC1)c1cccc(c1)C(F)(F)F)n(-c1ccccc1)c2=O
Cc1cccc(N2CCN(CCCC(=O)NCc3nc4ccc(F)cc4c(=O)n3-c3ccccc3)CC2)c1C
CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccc(OC)cc2)CC1
COc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccccc2)CC1
CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccccc2)CC1
CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3cc(F)ccc3c(=O)n2-c2ccc(OC)cc2)CC1
Fc1ccc2NC(=O)C(CCCCN3CCN(CC3)c3ccccc3)c2c1 |w:8.8|
C\C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)C(=C)[C@@H]2CC1 |r,t:1|
CC(C)NC[C@@H](COc1cccc2c1cccc2)O
FC(F)(F)c1cccc(c1)N1CCN(CCCCn2nc(ccc2=O)-n2ccc3ccccc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCn2nc(ccc2=O)-n2ccnc2)CC1
CCCCCCc1ccc2C(CN)c3ccc(OC)cc3Cc2c1
NCC1c2ccccc2Cc2cc(O)ccc12
CCCCCOc1ccc2C(CN)c3ccccc3Cc2c1
CCCCCCc1ccc(cc1)C(CN)c1ccccc1
NCC(c1ccccc1)c1ccc(Br)cc1
CCCCCCc1ccc(CCN)cc1
c1cc(ccc1CCN)Br
COc1cc(CC(C)N)c(OC)cc1O
Clc1cccc(c1)N1CCN(CCN2C(=O)C[C@H](NC(=O)C3CCCCC3)C2=O)CC1 |r|
Clc1cccc(c1)N1CCN(CCN2C(=O)C[C@H](NC(=O)c3ccccc3)C2=O)CC1 |r|
COc1ccccc1N1CCN(CCN2C(=O)CC(NC(C)=O)C2=O)CC1
COc1ccccc1N1CCN(CCN2C(=O)C[C@H](NC(=O)C3CCCCC3)C2=O)CC1 |r|
COc1ccccc1N1CCN(CCN2C(=O)C[C@H](NC(=O)CC3CC4CCC3C4)C2=O)CC1 |r,THB:22:23:26.27:29|
COc1ccccc1N1CCN(CCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1 |r,TLB:20:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22|
Clc1cccc(c1)N1CCN(CCNC(=O)[C@@H]2CCC(=O)N2C(=O)C2CCCCC2)CC1 |r|
COc1ccccc1N1CCN(CCNC(=O)[C@@H]2CCC(=O)N2C(=O)c2ccccc2)CC1 |r|
Clc1cccc(c1)N1CCN(CCNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)CC1 |r|
COc1ccccc1N1CCN(CCNC(=O)[C@@H]2CCCN2C(C)=O)CC1 |r|
COc1ccccc1N1CCN(CCNC(=O)[C@@H]2CCCN2C(=O)C2CCCCC2)CC1 |r|
COc1ccccc1N1CCN(CCNC(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1 |r,TLB:27:28:26.25.31:32,THB:29:28:25:31.30.32,29:30:27.28.33:25,27:26:28.33.29:32|
Clc1cccc(c1)N1CCN(CCNC(=O)[C@@H]2CCCN2C(=O)C2CCCC2)CC1 |r|
Clc1cccc(c1)N1CCN(CCCN2C(=O)C[C@H](NC(=O)C3CCCCC3)C2=O)CC1 |r|
Clc1cccc(c1)N1CCN(CCCNC(=O)[C@@H]2CCC(=O)N2C(=O)C2CCCCC2)CC1 |r|
COc1ccccc1N1CCN(CCCNC(=O)[C@@H]2CCCN2C(C)=O)CC1 |r|
Clc1cccc(c1)N1CCN(CCCCN2C(=O)C[C@H](NC(=O)c3ccccc3)C2=O)CC1 |r|
Clc1cccc(c1)N1CCN(CCCCNC(=O)[C@@H]2CCC(=O)N2C(=O)C2CCCCC2)CC1 |r|
Clc1cccc(c1)N1CCN(CCCCNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)CC1 |r|
COc1ccccc1N1CCN(CCCCNC(=O)[C@@H]2CCCN2C(=O)C2CCCCC2)CC1 |r|
COc1ccccc1N1CCN(CCCCNC(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1 |r,TLB:24:26:29.28.33:31,THB:24:26:29:33.32.31,27:28:31:35.26.34,27:26:29.28.33:31,34:26:29:33.32.31,34:32:29:35.27.26|
COc1ccccc1N1CCN(CCN2C(=O)CCC2=O)CC1
Clc1cccc(c1)N1CCN(CCN2C(=O)CCC2=O)CC1
COc1ccccc1N1CCN(CCN2C(=O)CC(C3CCCCC3)C2=O)CC1
Clc1cccc(c1)N1CCN(CCN2C(=O)CC(C3CCCCC3)C2=O)CC1
COc1ccccc1N1CCN(CCN2C(=O)CC3(CCCCC3)C2=O)CC1
Clc1cccc(c1)N1CCN(CCN2C(=O)CC3(CCCCC3)C2=O)CC1
COc1ccccc1N1CCN(CCNC(=O)[C@@H]2CCC(=O)N2C(=O)C2CCCCC2)CC1 |r|
O=S(=O)(c1ccccc1)C1(CCCN2CCc3ccccc3C2)CCC1
COc1ccccc1N1CCN(CC1)C(=O)NC(N)=NCc1cccc2ccccc12 |w:19.21|
CCOc1ccccc1CN=C(N)NC(=O)NC |w:10.10|
CC1CCN(CC1)C(N)=NCCNS(=O)(=O)c1cccc(C)c1 |w:9.10|
Cc1cccc(c1)S(=O)(=O)NCCN=C(N)N1CCC(CC1)c1ccccc1 |w:13.13|
COc1ccccc1N1CCN(CC1)C(N)=NCCNS(=O)(=O)c1cccc(C)c1 |w:16.18|
Cc1cccc(c1)S(=O)(=O)NCCCN=C(N)N1CCC(CC1)c1ccccc1 |w:14.14|
COc1ccccc1N1CCN(CC1)C(N)=NCCCNS(=O)(=O)c1cccc2ccccc12 |w:16.18|
Cc1cccc(c1)S(=O)(=O)NCCCCN=C(N)N1CCC(CC1)c1ccccc1 |w:15.15|
COc1ccccc1N1CCN(CC1)C(N)=NCCCCNS(=O)(=O)c1ccc(C)cc1 |w:16.18|
NC(=NCCCCNS(=O)(=O)c1cccc2ccccc12)N1CCc2ccccc2C1 |w:2.2|
FCCOc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1
CC(C)(C)c1nc(cc(n1)C(F)(F)F)N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1
O=C(NCCCCN1CC[N+]2(CCOc3ccccc23)CC1)c1cc2ccccn2n1
CC(C)(C)c1nc(cc(n1)C(F)(F)F)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
COc1cccc(c1)N1CCN(CCCCOc2ccc3c(C)cc(=O)oc3c2C(C)=O)CC1
CC(=O)c1c(OCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2F)ccc2c(C)cc(=O)oc12
Cc1cccc2nc(N3CCN(Cc4cnc[nH]4)CC3)c3cccn3c12
Fc1ccc2c(c1)nc(N1CCN(Cc3cnc[nH]3)CC1)c1cccn21
Fc1ccc2c(c1)nc(N1CCN(Cc3ncc[nH]3)CC1)c1cccn21
CN1CCN2C(C1)c1ccccc1Cc1ccccc21
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccccc2C#N)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccc(Cl)cc2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccncc2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCOCC2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2cnccn2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccccc2F)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2C#N)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccc(Cl)cc2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccncc2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCOCC2)ccc2c(C)cc(=O)oc12
COc1cccc(c1)N1CCN(CCCOc2ccc3c(C)cc(=O)oc3c2C(C)=O)CC1
CC(=O)c1c(OCCCN2CCN(CC2)c2cnccn2)ccc2c(C)cc(=O)oc12
Fc1ccc2[nH]c3CC(CCCNC[C@H]4COc5c6CC(=O)Nc6ccc5O4)CCc3c2c1 |r|
Fc1ccc2[nH]c3CCC(CNC[C@H]4COc5c6CC(=O)Nc6ccc5O4)Cc3c2c1 |r|
Fc1ccc2[nH]c3CCC(CN4CCN(CC4)c4cccc5[nH]c(=O)oc45)Cc3c2c1
Fc1ccc2[nH]c3CCC(CN4C[C@H]5C[C@@H]4CN5c4cccc5[nH]c(=O)oc45)Cc3c2c1 |r|
COc1cc2CCN(C)[C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23
Clc1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)cn1
C(N1CCN(CC1)c1ccccc1)c1cn(nn1)-c1ccccc1
C(N1CCN(CC1)c1ccccc1)c1cnn(c1)-c1ccccc1
Fc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccccc2)CC1
Clc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccccc2)CC1
Fc1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)cn1
Fc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccc(F)cc2)CC1
Clc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccc(Cl)cc2)CC1
COc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccc(Cl)cc2)CC1
Fc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccccc2)CC1
Clc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccccc2)CC1
Fc1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)nn1
Fc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(F)cc2)CC1
Clc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1
COc1ccc(cc1)N1CCN(Cc2cn(nn2)-c2ccc(Cl)cc2)CC1
[O-][N+](=O)c1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)nn1
CC(=O)Nc1ccc(cc1)-n1cc(CN2CCN(CC2)c2ccccc2)nn1
Cc1nc2ccccn2c1CN1CCN(CC1)c1ccccc1
Cc1nc2ccccn2c1CN1CCN(CC1)c1ccc(Cl)cc1
Clc1ccc2CCN(C(=O)Nc3cccnc3)c2c1Cl
Cc1cc2CCN(C(=O)Nc3cccnc3)c2cc1I
Cc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Br
Cc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
Cc1cc2N(CCc2cc1Cl)C(=O)Nc1cccnc1
Clc1cc2N(CCc2cc1I)C(=O)Nc1cccnc1
Cc1ccc2N(CCc2c1I)C(=O)Nc1cccnc1
Cc1ccc2N(CCc2c1Br)C(=O)Nc1cccnc1
Clc1ccc2N(CCc2c1Cl)C(=O)Nc1cccnc1
Clc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
Clc1ccc2CCN(C(=O)Nc3cccnc3)c2c1
Clc1ccc2N(CCc2c1)C(=O)Nc1cccnc1
O=C(Nc1cccnc1)N1CCc2ccccc12
C[C@H](N)Cn1ccc2ccc(F)cc12
CC(N)Cn1ccc2cc(Br)ccc12
CC(N)Cn1ccc2cc(Cl)ccc12
CC(N)Cn1ccc2cc(F)ccc12
CC(N)Cn1ccc2cc(C)ccc12
CCN1C(=N)N(C)\C(=C\c2c[nH]c3cc(F)ccc23)C1=O
CCN1C(=N)N(C)\C(=C/c2c[nH]c3ccccc23)C1=O
CN1C(=N)N(C)\C(=C\c2c[nH]c3ccccc23)C1=O
CN1C(=N)N(C)\C(=C\c2c[nH]c3cc(F)ccc23)C1=O
CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(nc2CC2CCCCC2)C(=O)N[C@H]2C[C@@H](C2)C(O)=O)c2ccccc12 |r,wU:27.28,wD:29.33,(8.76,1.15,;7.67,.06,;6.19,.46,;7.28,1.55,;8.07,-1.42,;6.98,-2.51,;6.59,-4,;8.07,-3.6,;5.5,-2.11,;5.1,-.63,;3.61,-.23,;2.52,-1.32,;1.03,-.92,;.56,.55,;-.98,.55,;-1.46,-.92,;-.21,-1.82,;-.21,-3.36,;-1.55,-4.13,;-2.88,-3.36,;-4.21,-4.13,;-4.21,-5.67,;-2.88,-6.44,;-1.55,-5.67,;-2.07,1.64,;-1.67,3.12,;-3.56,1.24,;-4.65,2.33,;-6.19,2.33,;-6.19,3.87,;-4.65,3.87,;-7.28,4.96,;-6.88,6.44,;-8.76,4.56,;2.92,-2.8,;1.83,-3.89,;2.23,-5.38,;3.72,-5.78,;4.81,-4.69,;4.41,-3.2,)|
Nn1c(CCCCN2CCN(CC2)c2ccc3ccccc3n2)nc2CCCCc2c1=O
Fc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N
COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCCCC1)C#N
O=C(NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1)c1ccccc1 |r,TLB:2:3:10:6.7|
COc1cccc(c1)C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:10:11:18:14.15|
COc1ccc(Cl)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:11:12:19:15.16|
COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:11:12:19:15.16|
COc1cc(N)c(Cl)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:12:13:20:16.17|
O=C(NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1)c1cccc2ccccc12 |r,TLB:2:3:10:6.7|
O=C(NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1)c1ccc2ccccc2c1 |r,TLB:2:3:10:6.7|
O=C(NC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12 |r,TLB:2:3:10:6.7|
O=C(NC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc2ccccc2c1 |r,TLB:2:3:10:6.7|
COc1cccc(C(=O)NC2C[C@H]3CC[C@H](C2)N3Cc2ccccn2)c1OC |r,TLB:9:10:17:13.14|
COc1cccc(C(=O)NC2C[C@H]3CC[C@H](C2)N3Cc2cccnc2)c1OC |r,TLB:9:10:17:13.14|
COc1cccc(C(=O)NC2C[C@H]3CC[C@H](C2)N3Cc2ccncc2)c1OC |r,TLB:9:10:17:13.14|
COc1cccc(C(=O)NC2C[C@H]3CC[C@H](C2)N3Cc2ccco2)c1OC |r,TLB:9:10:17:13.14|
COc1ccccc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:10:11:18:14.15|
COc1ccc(C(=O)NC2C[C@H]3CC[C@H](C2)N3Cc2ccco2)c(OC)c1 |r,TLB:8:9:16:12.13|
COc1ccc(OC)c(c1)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:12:13:20:16.17|
COc1ccc(cc1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:12:13:20:16.17|
COc1cc(OC)cc(c1)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:12:13:20:16.17|
COc1cc(cc(OC)c1OC)C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:14:15:22:18.19|
COc1ccc(Cl)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:11:12:19:15.16|
COc1ccc(F)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:11:12:19:15.16|
COc1cc(Cl)ccc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:11:12:19:15.16|
[O-][N+](=O)c1cc(Cl)ccc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:12:13:20:16.17|
COc1cc(N)c(Cl)cc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1 |r,TLB:12:13:20:16.17|
O=C(NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1)c1cccc2ccccc12 |r,TLB:2:3:10:6.7|
O=C(NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1)c1ccc2ccccc2c1 |r,TLB:2:3:10:6.7|
C(CCOc1cccc2ccccc12)CCN1CCCCC1
C(CCOc1cccc2ccccc12)CCN1CCCCCC1
CCN(CC)CCOC(=O)C(CC1CCCO1)Cc1cccc2ccccc12
CCN(CC)CCOC(=O)[C@H](C[C@@H]1CCCO1)Cc1cccc2ccccc12 |r|
CCN(CC)CCOC(=O)[C@@H](C[C@@H]1CCCO1)Cc1cccc2ccccc12 |r|
CCN(CC)CCOC(=O)[C@@H](C[C@H]1CCCO1)Cc1cccc2ccccc12 |r|
CCN(CC)CCOC(=O)[C@H](C[C@H]1CCCO1)Cc1cccc2ccccc12 |r|
NC[C@H]1C[C@@H]1c1cc(F)ccc1OCC1CC1 |r|
CCOc1ccccc1[C@H]1C[C@@H]1CN |r|
Clc1ccc2Oc3ncccc3C(NCCN3CCOCC3)=Nc2c1 |c:23|
Clc1ccc2Oc3ncccc3C(=Nc2c1)N1CCNCC1 |c:13|
Clc1ccc2Oc3ncccc3C(=Nc2c1)N1CCN(Cc2ccccc2)CC1 |c:13|
Clc1ccc2Oc3ncccc3C(=Nc2c1)N1CCN(CCc2ccccc2)CC1 |c:13|
Clc1ccc2Oc3ncccc3C(=Nc2c1)N1CCN(CC1)C1CCCCC1 |c:13|
CN1CCC(CC1)NC1=Nc2cc(Cl)ccc2Oc2ncccc12 |t:9|
Clc1ccc2Oc3ncccc3C(NC3CCN(Cc4ccccc4)CC3)=Nc2c1 |c:29|
Clc1ccc2Oc3ncccc3C(NCCN3CCCCC3)=Nc2c1 |c:23|
CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Oc2ncccc12 |t:8|
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(cc1)[N+]([O-])=O |r|
C[C@@H]1[C@H]2CN(CCC3(CCCCC3)C(O)=O)CC[C@@H]2Cc2[nH]c3ccc(cc3c12)C(F)(F)F |r|
Clc1ccc(cc1)N1CCN(CCCc2nc3ccccc3s2)CC1
Clc1ccc(cc1)N1CCN(CCCCc2nc3ccccc3s2)CC1
C(CCc1nc2ccccc2s1)CN1CCN(CC1)c1ncccn1
C(CCc1nc2ccccc2s1)CN1CCc2ccccc2C1
C(CCc1nc2ccccc2s1)CN1Cc2ccccc2C1
Clc1ccc(cc1)N1CCN(CCCC(=O)c2nc3ccccc3s2)CC1
O=C(CCCN1CCN(CC1)c1ccccc1)c1nc2ccccc2s1
O=C(CCCN1CCC(CC1)c1ccccc1)c1nc2ccccc2s1
O=C(CCCN1CCN(CC1)c1ncccn1)c1nc2ccccc2s1
O=C(CCCCN1Cc2ccccc2C1)c1nc2ccccc2s1
O=C(CCCCN1CCN(CC1)c1ncccn1)c1nc2ccccc2s1
O=C(CCCCN1CCN(CC1)c1ccccc1)c1nc2ccccc2s1
O=C(CCCCN1CCC(CC1)c1ccccc1)c1nc2ccccc2s1
Clc1ccc(cc1)N1CCN(CCCCC(=O)c2nc3ccccc3s2)CC1
Fc1ccc(OCCCN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
O=c1[nH]c2ccccc2n1C1CCN(CC1)C1CCCCC1
COc1ccc(cc1)N1CCN(CC[C@@H](OC(N)=O)c2ccccc2)CC1 |r|
NC(=O)O[C@@H](CCN1CCN(CC1)c1ccccc1)c1ccccc1 |r|
NC(=O)O[C@H](CCN1CCN(CC1)c1ccccc1)c1ccccc1 |r|
Cc1ccc(cc1)N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
NC(=O)OC(CCN1CCN(CC1)c1ccc(cc1)C(F)(F)F)c1ccccc1
Cc1cccc(c1)N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
Cc1ccccc1N1CCN(CCC(OC(N)=O)c2ccccc2)CC1
NC(=O)OC(CCN1CCN(CC1)c1ccccc1Cl)c1ccccc1
O=C(CCN1CCN(CC1)c1ccccc1)c1ccccc1
O[C@@H](CCN1CCN(CC1)c1ccccc1)c1ccccc1 |r|
O[C@H](CCN1CCN(CC1)c1ccccc1)c1ccccc1 |r|
O=C(C1CCCCC1)N(CCN1CCC(=CC1)c1ccccc1)c1ccccn1 |c:15|
O=C(C1CCCCC1)N(CCN1CCN(CC1)c1ccccc1)c1ccccn1
Clc1cccc(C2CCN(CCCCOc3ccc4scnc4c3)CC2)c1Cl
COc1ccc(cc1NC1CCN(C)CC1)S(=O)(=O)n1cc(C)c2cc(Cl)cnc12
COc1ccc(cc1NC1CCN(C)CC1)S(=O)(=O)n1cc(C)c2cc(Cl)ccc12
CC(=O)Nc1ccc(CCN2CCC(COc3nc4ccccc4c4cn(C)cc34)CC2)cc1
COCc1ccc(CCN2CCC(COc3nc4ccccc4c4cn(C)cc34)CC2)cc1
Cn1cc2c(OCC3CCN(CCc4ccc(CO)cc4)CC3)nc3ccccc3c2c1
Cn1cc2c(OCC3CCN(CCc4ccccc4C(O)=O)CC3)nc3ccccc3c2c1
Cn1cc2c(OCC3CCN(CCc4ccc(cc4)C(O)=O)CC3)nc3ccccc3c2c1
Cn1cc2c(OCC3CCN(CCc4ccc(N)cc4)CC3)nc3ccccc3c2c1
Cn1cc2c(OCC3CCN(CCN4CCOCC4)CC3)nc3ccccc3c2c1
CC(C)n1cc2c(OCC3CCN(CCc4ccccc4)CC3)nc3ccccc3c2c1
Cn1cc2c(OCC3CCN(CCc4ccccc4)CC3)nc3ccccc3c2c1
CCCCN1CCC(COc2nc3ccccc3c3cn(C)cc23)CC1
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccc(cc3)C(O)=O)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccc(N)cc3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccc(cc3)[N+]([O-])=O)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccc(O)cc3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCCN(C)C)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCN3CCOCC3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCC3CCCCC3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CC[N+](C)(CCc3ccccc3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccccn3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(Cc3ccccc3)CC2)c2ccccc12
CC(C)n1nc(C(=O)NCC2CCN(CCc3ccccc3)CC2)c2ccccc12
CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1
CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1
CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
C(Oc1cc(COc2ccccc2)on1)[C@@H]1CCCN1 |r|
C(Oc1cc(COc2ccccc2)on1)[C@@H]1CCN1 |r|
Cc1ccc(c(c1)C)Sc2ccccc2N3CCNCC3
COc1ccc(CN2C3C4C5C6C4C2(O)C2C6CC5C32)cc1OC |TLB:8:19:10.11:17,13:15:10.11:17,THB:9:10:19.15:17,18:19:9.12:7,10:9:19.15:7,12:11:19.15:17,16:15:9.12:7,11:12:19.15:7,6:7:9.12:19.15|
COc1cccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)c1OC |TLB:10:21:12.13:19,15:17:12.13:19,THB:11:12:21.17:19,20:21:11.14:9,12:11:21.17:9,14:13:21.17:19,18:17:11.14:9,13:14:21.17:9,8:9:11.14:21.17|
COc1cccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)c1 |TLB:10:21:12.13:19,15:17:12.13:19,THB:11:12:21.17:19,20:21:11.14:9,12:11:21.17:9,14:13:21.17:19,18:17:11.14:9,13:14:21.17:9,8:9:11.14:21.17|
COc1ccccc1CCN1C2C3C4C5C3C1(O)C1C5CC4C21 |TLB:11:22:13.14:20,16:18:13.14:20,THB:12:13:22.18:20,21:22:12.15:10,13:12:22.18:10,15:14:22.18:20,19:18:12.15:10,14:15:22.18:10,9:10:12.15:22.18|
COc1ccccc1CN1C2C3C4C5C3C1(O)C1C5CC4C21 |TLB:10:21:12.13:19,15:17:12.13:19,THB:11:12:21.17:19,20:21:11.14:9,12:11:21.17:9,14:13:21.17:19,18:17:11.14:9,13:14:21.17:9,8:9:11.14:21.17|
CCCN1CCC(CC1)n1c2ccc(Cl)cc2[nH]c1=O
COc1ccc2c(C)c(oc2c1)C(=O)N(CCCN1CCCCC1)c1ccccc1
COc1cc2oc(C(=O)N(CCCN3CCCCC3)c3ccccc3)c(C)c2cc1OC
COc1ccccc1N1CCN(Cc2ccc3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCN(CC3)c3ccc(Cl)cc3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCN(CC3)c3ccccc3OC)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCN(C)CC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCOCC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCCCC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN(C)C)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CO)c3cccccc23)CC1
CCCC#Cc1cc(CN2CCN(CC2)c2ccccc2OC)c2cccccc12
COc1ccccc1N1CCN(Cc2cc(C#Cc3ccccc3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(C#C)c3cccccc23)CC1
COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Cl)cc(Cl)c1Cl
COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)cc(F)c1Br
COc1ccc(cc1N1CCNCC1)S(=O)(=O)N1CCc2ccc(I)cc12
COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)ccc1Br
CN(C)CCCCC1CC2N(O1)c1ccccc1Cc1ccccc21
C(C1CC2N(O1)c1ccccc1Cc1ccccc21)N1CCOCC1
CN(C)CCC1CC2N(O1)c1ccccc1Cc1ccccc21
CN(CC1CC2N(O1)c1ccccc1Cc1ccccc21)C(=O)C(F)(F)F
C(C1CC2N(O1)c1ccccc1Cc1ccccc21)N1Cc2ccccc2C1
CN1CCN(CC2CC3N(O2)c2ccccc2Cc2ccccc32)CC1
CN(C)C(=O)C1CC2N(O1)c1ccccc1Cc1ccccc21
CC(C)N(CC1CC2N(O1)c1ccccc1Cc1ccccc21)C(C)C
C(C1CC2N(O1)c1ccccc1Cc1ccccc21)N1CCNCC1
CCN(CC)CC1CC2N(O1)c1ccccc1Cc1ccccc21
Clc1cccc(c1)N1CCN(CC2CC3N(O2)c2ccccc2Cc2ccccc32)CC1
CN(C)CCCC1CC2N(O1)c1ccccc1Cc1ccccc21
NCC1CC2N(O1)c1ccccc1Cc1ccccc21
CNCC1CC2N(O1)c1ccccc1Cc1ccccc21
C(C1CC2N(O1)c1ccccc1Cc1ccccc21)N1CCCC1
C(C1CC2N(O1)c1ccccc1Cc1ccccc21)N1CCN(CC1)c1ccccc1
O=C1N(CC2CC3N(O2)c2ccccc2Cc2ccccc32)C(=O)c2ccccc12
CN(C)CC1CC2N(O1)c1cc(Cl)ccc1Oc1ccccc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1cc(C)ccc21
COc1ccc2Cc3ccccc3N3OC(CN(C)C)CC3c2c1
CN(C)CC1CC2N(O1)c1ccccc1Cc1cccc(F)c21
CN(C)CC1CC2N(O1)c1cc(F)ccc1Cc1ccc(F)cc21
CN(C)CC1CC2N(O1)c1cc(Cl)ccc1Cc1ccccc21
CN(C)CC1CC2N(O1)c1cccc(C)c1Cc1ccccc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1ccc(cc21)C(F)(F)F
CN(C)CC1CC2N(O1)c1ccccc1Cc1cccc(C)c21
CN(C)CC1CC2N(O1)c1ccccc1Cc1c(F)cccc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1c(Cl)cccc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1ccc(F)cc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1c2cccc1C(F)(F)F
CN(C)CC1CC2N(O1)c1cc(F)ccc1Cc1ccccc21
CN(C)CC1CC2N(O1)c1cc(ccc1Cc1ccccc21)-c1ccccc1
CN(C)CC1CC2N(O1)c1c(Cl)cccc1Cc1ccccc21
CN(C)CC1CC2N(O1)c1cc(C)ccc1Cc1ccccc21
CN(C)CC1CC2N(O1)c1ccccc1Cc1cccc(c21)C(F)(F)F
CN(C)CC1CC2N(O1)c1cccc(F)c1Cc1ccccc21
CN(C)CC1CC2N(O1)c1ccc(F)cc1Cc1ccccc21
COc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ccccn3)ccc12
Cc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ncccn3)ccc12
COc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ccccc3)ccc12
Cc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ccccn3)ccc12
Cc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ccccc3)ccc12
COc1ccccc1N1CCN(CCCOc2ccc3c(OC)cc(=O)oc3c2)CC1
COc1ccccc1N1CCN(CCCOc2ccc3c(C)cc(=O)oc3c2)CC1
COc1cc(=O)oc2cc(OCCCN3CCN(CC3)c3ncccn3)ccc12
CC[Si](CC)(CC)C#Cc1cccc2C=C(C(Oc12)C(F)(F)F)[N+]([O-])=O |c:14|
CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r|
C[C@H]1CN(CCCNC(=O)CN2CCc3ccccc3C2)C[C@@H](C)O1 |r|
CN(C[C@@H]1Cc2ccccc2O1)Cc1nc(oc1C)-c1cccc(F)c1F |r|
Cc1cccc(c1)N1CCN(CCNc2cncc(Cl)n2)CC1
CC(C)c1nc(CN2CC[C@@H](C2)c2ccccc2)cs1 |r|
Clc1ccccc1OCCCCN1CCNCC1
C[C@H](CNc1cncc(Cl)n1)N1CCN(CC1)c1ccccc1 |r|
O[C@@H](COC[C@@H]1CCCO1)CN1CCN(CC1)c1ccccc1F |r|
CO[C@@H]1CCCN(Cc2nc(oc2C)-c2cccc(Oc3ccccc3)c2)C1 |r|
Cc1oc(nc1CN1CCN(CC1)[C@@H]1CCc2ccccc2C1)-c1ccco1 |r|
Clc1cncc(NCCCCN2CCN(CC2)c2ccccc2)n1
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccccc1Cl
CCN1CCN(CCCNC(=O)c2ccc(F)cc2Cl)CC1
CCOc1ccc(cc1)[C@H](O)CN1CCN(CC1)c1ccccc1F |r|
C(N1CCCN(CC1)c1nccs1)c1coc(n1)-c1ccccc1
CN(C[C@@H]1Cc2ccccc2O1)Cc1nc(oc1C)-c1ccco1 |r|
O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1nccs1
N#Cc1c(CN2CCN(CCc3ccccc3)CC2)cn2ccccc12
CN(C)Cc1cccc(CN\C=C2\C(=O)NC(=O)c3ccccc23)c1
Cc1ccn(CCN2CCC(Cc3ccccc3F)CC2)n1
Cc1cc(C)n(n1)C1CN(CCCc2nc(no2)-c2ccccc2)C1
OCC(=O)NC[C@H]1CCN(Cc2csc(n2)-c2ccccc2)C1 |r|
Cc1[nH]ncc1C(=O)NCCCN1CCN(CC1)c1cccc(C)c1
COC(=O)c1ccc(cc1)-c1nc(CN(C)C[C@@H]2Cc3ccccc3O2)c(C)o1 |r|
COc1ccc(cc1C)-c1nc(CN(C)C[C@@H]2Cc3ccccc3O2)c(C)o1 |r|
CN(C[C@@H]1Cc2ccccc2O1)Cc1nc(oc1C)-c1ccc(C)s1 |r|
Cc1oc(nc1CN1CCO[C@H](CCN)C1)-c1ccc2ccccc2c1 |r|
CCCc1nc(CN2CC[C@@H](C2)c2ccccc2)cs1 |r|
Fc1ccccc1N1CCN(CCCNc2cncc(Cl)n2)CC1
Clc1cncc(NCCCN2CCN(CC2)c2ccccc2)n1
Fc1ccc(cc1)N1CCN(CCNc2cncc(Cl)n2)CC1
CN1CCN(CCCNC(=O)c2cc(=O)c3ccccc3[nH]2)CC1
CN1CCN(CCCNC(=O)c2ccc3N(CCc3c2)C(C)=O)CC1
CN1CCN(CCCCNC(=O)c2cn3ccccc3n2)CC1
CCN(CCc1ccccn1)Cc1csc(n1)C1CCCC1
CC(C)(C)c1nc(CN2CCN(Cc3ccccn3)CC2)cs1
Cc1ccc(s1)-c1cc(n[nH]1)C(=O)NCCCCN1CCOCC1
COC[C@@H](C)N1CCN(CC1)c1cccc(F)c1C#N |r|
CCn1nnnc1Cc1ccc2[nH]cc(CCN(C)C)c2c1
CN(C)CCc1c[nH]c2ccc(Cc3nnn(C)n3)cc12
CN(C)CCc1c[nH]c2ccc(Cc3nnn[nH]3)cc12
CCn1nnc(Cc2ccc3[nH]cc(CCN(C)C)c3c2)n1
CN(C)CCc1c[nH]c2ccc(cc12)-n1ccnc1C
CN(C)CCc1c[nH]c2ccc(Cc3nnnn3C)cc12
CN(C)CCc1c[nH]c2ccc(Cc3ncnn3C)cc12
CN(C)CCc1c[nH]c2ccc(Cn3ccnn3)cc12
CN(C)CCc1c[nH]c2ccc(Cn3ccnc3C)cc12
CN(C)CCc1c[nH]c2ccc(Cc3nncn3C)cc12
CN(C)CCc1c[nH]c2ccc(Cn3ncnn3)cc12
CN(C)CCc1c[nH]c2ccc(Cn3ccnc3)cc12
CN(C)CCc1c[nH]c2ccc(Cc3nc(N)no3)cc12
CN(C)CCc1c[nH]c2ccc(Cn3cnnn3)cc12
FC(F)(F)c1ccccc1CCN1CCN(CC1)c1nc2ccsc2n2cccc12
C[N+]1(Cc2ccccc2)CCN(CC1)c1nc2ccsc2n2cccc12
C1CCN(CC1)c1nc2ccsc2n2cccc12
O=C(CN1CCN(CC1)c1nc2ccsc2n2cccc12)N1CCCC1
C1CN(CCO1)c1nc2ccsc2n2cccc12
C1CN(CCN1)c1nc2ccsc2n2cccc12
C(\C=C\c1ccccc1)N1CCN(CC1)c1nc2ccsc2n2cccc12
Fc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2ccsc2n2cccc12
C(N1CCN(CC1)c1nc2sccc2n2cccc12)c1ccc2OCOc2c1
C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccccc1
C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccc2OCOc2c1
CN1CCN(CC1)c1nc2sc(cc2n2cccc12)-c1ccccc1
Clc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1Cl
Clc1ccc(CN2CCN(CC2)c2nc3sccc3n3cccc23)c(Cl)c1
C(N1CCN(CC1)c1nc2scc(-c3ccccc3)c2n2cccc12)c1ccccc1
CCOC(=O)N1CCN(CC1)c1nc2ccsc2n2cccc12
Clc1ccc(cc1)N1CCN(CC1)c1nc2ccsc2n2cccc12
C(N1CCN(CC1)c1nc2sccc2n2cccc12)c1ccccc1
C1CN(CCC1c1ccccc1)c1nc2ccsc2n2cccc12
CCOC(=O)CN1CCN(CC1)c1nc2ccsc2n2cccc12
FC(F)(F)c1cccc(c1)N1CCN(CC1)c1nc2sccc2n2cccc12
C1CN(CCN1c1ccccc1)c1nc2ccsc2n2cccc12
CCCN1CCN(CC1)c1nc2ccsc2n2cccc12
FC(F)(F)c1cccc(c1)N1CCN(CC1)c1nc2ccsc2n2cccc12
CN1CCN(CC1)c1nc2cc(sc2n2cccc12)-c1ccccc1
Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1
C1CN(CCN1)c1nc2cc(sc2n2cccc12)-c1ccccc1
FC(F)(F)c1cccc(c1)N1CCN(CC1)c1nc2scc(-c3ccccc3)c2n2cccc12
Fc1ccc(cc1)N1CCN(CC1)c1nc2ccsc2n2cccc12
FC(F)(F)c1cccc(c1)N1CCN(CC1)c1nc2cc(sc2n2cccc12)-c1ccccc1
Clc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)c(Cl)c1
CN1CCN(CC1)c1nc2ccsc2n2cccc12
Cc1sc2c(nc(N3CCN(Cc4ccccc4)CC3)c3cccn23)c1C
C(N1CCN(CC1)c1nc2cc(sc2n2cccc12)-c1ccccc1)c1ccccc1
C(C1CC1)N1CCN(CC1)c1nc2ccsc2n2cccc12
C(N1CCN(CC1)c1nc2sc(cc2n2cccc12)-c1ccccc1)c1ccccc1
C=CCN1CCN(CC1)c1nc2sccc2n2cccc12
Clc1ccc(CN2CCN(CC2)c2nc3sccc3n3cccc23)cc1Cl
C=CCN1CCN(CC1)c1nc2ccsc2n2cccc12
Fc1ccc(CN2CCN(Cc3nc4ccsc4n4cccc34)CC2)cc1
Fc1ccc(CN2CCN(CC2)c2nc3sccc3n3cccc23)cc1
C1CN(CC=C1)c1nc2ccsc2n2cccc12 |c:4|
FC(F)(F)c1cccc(c1)N1CCN(CC1)c1nc2sc(cc2n2cccc12)-c1ccccc1
Clc1ccc(cc1)C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccccc1
COc1ccc(CC2NCCc3c2[nH]c2ccc(C)cc32)cc1OC
Cc1ccc2c(c1)c3c([nH]2)[C@@H](NCC3)Cc4ccc(c(c4Cl)OC)OC
COc1ccc(CC2NCCc3c2[nH]c2c(Br)c(C)ccc32)cc1OC
COc1ccc(CC2NCCc3c2[nH]c2ccccc32)cc1OC
COc1ccc(CC2NCCc3c2[nH]c2c(C)c(C)ccc32)cc1OC
COc1ccc(CC2NCCc3c2[nH]c2cc(C)c(C)cc32)cc1OC
COc1ccc(CC2NCCc3c2[nH]c2ccc(C)cc32)c(Br)c1OC
Cc1ccc2NC3C(CCNC3Cc3cccc4ccccc34)c2c1F
Cc1ccc2NC3C(CCNC3Cc3cccc4ccccc34)c2c1
COc1ccc2c(c1)nc(N1CCN(CCCCn3cccn3)CC1)c1cccn21
COc1ccc2nc(N3CCN(Cc4ccc(F)cc4)CC3)c3cccn3c2n1
COc1ccc2c(c1)nc(N1CCN(Cc3ccc(F)cc3)CC1)c1cccn21
C(N1CCN(CC1)c1nc2cccnc2n2cccc12)c1ccccc1
Clc1ccc2c(c1)nc(N1CCN(Cc3ccc4OCOc4c3)CC1)c1cccn21
C(N1CCN(CC1)c1nc2cccnc2n2cccc12)c1ccc2OCOc2c1
Fc1ccc(CN2CCN(CC2)c2nc3cccnc3n3cccc23)cc1
Fc1ccc(CN2CCN(Cc3nc4ccccc4n4cccc34)CC2)cc1
C(N1CCN(CC1)c1nc2ccccc2n2cccc12)c1ccccc1
C(N1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12)c1ccccc1
C1CN(CCN1c1ccccc1)c1nc2cccnc2n2cccc12
C(N1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12)c1ccc2OCOc2c1
Clc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2c1
Clc1ccc(CN2CCN(CC2)c2nc3cccnc3n3cccc23)c(Cl)c1
CCOC(=O)N1CCN(CC1)c1nc2cccnc2n2cccc12
Cc1ccnc2c1nc(N1CCN(Cc3ccccc3)CC1)c1cccn21
C(N1CCN(CC1)c1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2n1)c1ccccc1
C(Oc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2n1)c1ccccc1
COc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2n1
C=CCN1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12
C1CN(CCN1)c1nc2cccnc2n2cccc12
C=CCN1CCN(CC1)c1nc2cccnc2n2cccc12
Fc1ccc(CN2CCN(CC2)c2nc3cc(Cl)ccc3n3cccc23)cc1
CN1CCN(CC1)c1nc2cccnc2n2cccc12
Cc1ccc2c(c1)nc(N1CCN(Cc3ccc(F)cc3)CC1)c1cccn21
Cc1ccnc2c1nc(N1CCN(Cc3ccc(F)cc3)CC1)c1cccn21
C(N1CCN(CC1)c1ncccc1-n1cccc1)c1ccccc1
Clc1ccc2c(c1)nc(N1CCN(Cc3ccccc3)CC1)c1cccn21
Fc1ccc(CN2CCN(CC2)c2nc3ccccc3n3cccc23)cc1
COc1cc2CCN(C(=O)c3ccc(cc3)-c3ccc(cc3C)-c3noc(C)n3)c2cc1OCCN(C)C
COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1N1CCN(C)CC1
COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1NCCN(C)C
CN(C)CCOc1cc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc2CCOc12
CN1CCC2(COc3ccc(NC(=O)c4ccc(cc4)-c4ccc(cc4C)-c4noc(C)n4)cc23)CC1
COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1CCCN(C)C
CN1CCN(CC1)c1cc(NC(=O)c2ccc(Br)c(C)c2)ccc1C
CN(C)CCN1CCOc2ccc(NC(=O)c3ccc(cc3)-c3ccc(cc3C)-c3noc(C)n3)cc12
CN1CCN(CC1)c1cccc(NC(=O)c2ccc(Br)c(C)c2)c1
COc1ccc(cc1OCCN(C)C)N1CCN(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)-n1ccn(-c2cc(F)cc(F)c2)c1=O
COc1ccc(cc1OCCN(C)C)N1CCN(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1cc(F)cc(F)c1
COc1cc2CCN(C(=O)\C=C\c3ccccc3Cl)c2cc1OCCN1CCCCC1
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1ccccc1Cl
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1ccccc1
COc1ccc(cc1OCCN1CCCCC1)-n1cc(O)n(-c2cccc(F)c2)c1=O
COc1ccc(cc1OCCN1CCCCC1)-n1ccn(-c2cccc(F)c2)c1=O
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCO)N1CCN(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCN1CCOCC1)N1CCN(C1=O)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1cccc(Cl)c1Cl
COc1ccc(cc1OCCN1CCOCC1)N1CCN(C1=O)c1ccc(C)c(c1)C(F)(F)F
Clc1ccc(cc1Cl)N1CCN(C1=O)c1ccc(OCc2ccccn2)nc1
Clc1ccc(cc1Cl)N1CCN(C1=O)c1ccc(OCCN2CCCCC2)nc1
COc1ccc(cc1OCCN1CCOCC1)N1CCN(C1=O)c1cccc(F)c1
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1ccc(C)c(c1)C(F)(F)F
Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCS4(=O)=O)CC3)cccc2n1
Cc1ccc2c(OCCN3CCC(Cc4cccc(NS(C)(=O)=O)c4)CC3)cccc2n1
Cc1ccc2c(cccc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCC2CCc3occc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2CCc3occc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CC2Cc3occc3C(=O)C2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CC2Cc3occc3C(=O)C2)CC1
Fc1ccc(cc1)C(=O)N1CCN(CC2Cc3occc3C(=O)C2)CC1
CCOC(=O)c1oc2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c2c1C
Fc1ccc2c(noc2c1)C1CCN(CC2Cc3oc(cc3C(=O)C2)-c2ccccc2)CC1
COC(=O)c1coc2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c12
CCOC(=O)c1oc2CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)CC(=O)c2c1C
Fc1ccc(cc1)C(=O)C1CCN(CC2Cc3oc(cc3C(=O)C2)-c2ccccc2)CC1
COC(=O)c1coc2CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)CC(=O)c12
Fc1ccc2c(noc2c1)C1CCN(C[C@@H]2Cc3occc3C(=O)C2)CC1 |r|
Fc1ccc2c(noc2c1)C1CCN(C[C@H]2Cc3occc3C(=O)C2)CC1 |r|
Clc1c(cnn(Cc2cccc(NC(=O)c3ccc(cc3)-c3ccccc3)c2)c1=O)N1CCNCC1
Cc1ccc(Cn2ncc(N3CCNCC3)c(Cl)c2=O)cc1NC(=O)c1ccc(cc1)-c1ccccc1
Cc1c(Cn2ncc(N3CCNCC3)c(Cl)c2=O)cccc1NC(=O)c1ccc(cc1)-c1ccccc1
Cc1c(Cn2ncc(N3CCNCC3)c(Cl)c2=O)cccc1NC(=O)c1ccc(cc1)-c1cccc(c1)C(N)=O
COc1ccc(cn1)-c1ccc(cc1)C(=O)Nc1cccc(Cn2ncc(cc2=O)N2CCNCC2)c1C
Cc1c(Cn2ncc(cc2=O)N2CCNCC2)cccc1NC(=O)c1ccc(cc1)-c1ccccc1
COc1ccc(cn1)-c1ccc(cc1)C(=O)Nc1cccc(Cn2ncc(N3CCNCC3)c(Cl)c2=O)c1C
Clc1cccc(c1)N1CCN(CCN2Cc3ccccc3C2)C1=O
Fc1ccc(cc1)C(=O)C1CCN(CC2CC(=O)c3cncnc3C2)CC1
Fc1ccc2c(noc2c1)C1CCN(CC2CC(=O)c3cncnc3C2)CC1
CSc1ncc2C(=O)CC(CN3CCC(CC3)c3noc4cc(F)ccc34)Cc2n1
CNc1ncc2C(=O)CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)Cc2n1
CNc1ncc2C(=O)CC(CN3CCC(CC3)c3noc4cc(F)ccc34)Cc2n1
Fc1ccc(cc1)C(=O)C1CCN(CC2CC(=O)c3cnc(nc3C2)-c2ccccc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CC2CC(=O)c3cnc(nc3C2)-c2ccccc2)CC1
CSc1ncc2C(=O)CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)Cc2n1
Clc1cccc(c1)N1CCN(CCCn2cnc3ccccc3c2=O)CC1
Clc1cccc(c1)N1CCN(CCCCn2n(-c3ccccc3)c(=O)ccc2=O)CC1
COc1ccccc1N1CCN(CCCn2n(-c3ccccc3)c(=O)ccc2=O)CC1
COc1ccccc1N1CCN(CCCCn2n(-c3ccccc3)c(=O)ccc2=O)CC1
Clc1cccc(c1)N1CCN(CCCCn2cnc3ccccc3c2=O)CC1
COc1ccccc1N1CCN(CCCn2cnc3ccccc3c2=O)CC1
COc1ccccc1N1CCN(CCCCn2cnc3ccccc3c2=O)CC1
Clc1cccc(c1)N1CCN(CCCCn2n(-c3ccccc3)c(=O)c3ccccc3c2=O)CC1
COc1ccccc1N1CCN(CCCn2n(-c3ccccc3)c(=O)c3ccccc3c2=O)CC1
Clc1cccc(c1)N1CCN(CCCn2n(-c3ccccc3)c(=O)ccc2=O)CC1
Clc1cccc(c1)N1CCN(CCCn2n(-c3ccccc3)c(=O)c3ccccc3c2=O)CC1
COc1ccccc1N1CCN(CCCCn2n(-c3ccccc3)c(=O)c3ccccc3c2=O)CC1
C1CN(CCN1)C1=Cc2ccccc2Cn2ccnc12 |t:7|
OC(=O)CCN1CCN(CC1)C1=Cc2ccccc2Cn2ccnc12 |t:12|
CC(C)(CN1CCN(CC1)C1=Cc2ccccc2Cn2ccnc12)C(O)=O |t:11|
OC(=O)C(=C)CN1CCN(CC1)C1=Cc2ccccc2Cn2ccnc12 |t:13|
OC(=O)C1CC(C1)N1CCN(CC1)C1=Cc2ccccc2Cn2ccnc12 |t:15,(5.93,-34.54,;4.41,-34.32,;3.85,-32.88,;3.45,-35.52,;3.63,-37.05,;2.1,-37.22,;1.92,-35.69,;1.14,-38.42,;1.7,-39.85,;.75,-41.05,;-.77,-40.83,;-1.34,-39.4,;-.38,-38.2,;-1.72,-42.04,;-3.23,-41.71,;-4.44,-42.68,;-5.78,-41.92,;-7.1,-42.69,;-7.1,-44.23,;-5.77,-45,;-4.44,-44.22,;-3.22,-45.18,;-1.71,-44.83,;-.58,-45.89,;.78,-45.14,;.49,-43.62,;-1.05,-43.43,)|
OC(=O)C1CCC(CC1)N1CCN(CC1)C1=Cc2ccccc2Cn2ccnc12 |t:17,(4.66,4.39,;3.14,4.62,;2.58,6.05,;2.18,3.42,;2.74,1.98,;1.78,.79,;.25,1.02,;-.31,2.45,;.66,3.65,;-.71,-.18,;-.15,-1.61,;-1.1,-2.81,;-2.62,-2.58,;-3.19,-1.16,;-2.23,.05,;-3.57,-3.79,;-5.08,-3.46,;-6.29,-4.44,;-7.62,-3.67,;-8.95,-4.44,;-8.95,-5.98,;-7.62,-6.75,;-6.29,-5.98,;-5.07,-6.94,;-3.56,-6.59,;-2.42,-7.65,;-1.07,-6.89,;-1.36,-5.38,;-2.9,-5.18,)|
Cc1nc2C(=Cc3ccccc3Cn2c1C)N1CCN(CC(C)(C)C(O)=O)CC1 |c:4|
Cc1cn2Cc3ccccc3C=C(N3CCN(CC(C)(C)C(O)=O)CC3)c2n1 |t:12|
CC(C)(CN1CCN(CC1)C1=Cc2ccccc2Cn2cc(Cl)nc12)C(O)=O |t:11|
CC(C)(CN1CCN(CC1)C1=Cc2ccccc2Cn2cc(F)nc12)C(O)=O |t:11|
COc1cnc2C(=Cc3ccccc3Cn12)N1CCN(CC(C)(C)C(O)=O)CC1 |c:6|
CC1CN(CC(C)N1CCC(O)=O)C1=Cc2ccccc2Cn2ccnc12 |t:14|
CC(C)(CN1CCN(CC1)C1=Cc2ccccc2Cn2c(Cl)cnc12)C(O)=O |t:11|
CC(C)(CN1CCCN(CC1)C1=Cc2ccccc2Cn2ccnc12)C(O)=O |t:12|
CCc1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
CC(C)c1nc2c(ccnc2n1Cc1cccc(F)c1)N1CCNCC1
CC(C)c1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
CCc1nc2c(ccnc2n1Cc1cccc(F)c1)N1CCNCC1
NCCc1coc2ccc(cc12)C(N)=O
CN(C)CCc1coc2ccc(cc12)C(N)=O
O=C1CC2(CCCC2)CC(=O)N1CCCCNCC1COc2ccccc2C1
CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)CC1COc2cccc(OC)c2C1
CCCN(CCC)CC1COc2cccc(OC)c2C1
CCCN1CCN(Cc2ccccc2)CC11COc2cccc(OC)c2C1
COc1cccc2OCC(CNCCCCN3C(=O)CC4(CCCC4)CC3=O)Cc12
CCCN(CCC)CC1(COc2cccc(OC)c2C1)N(CCC)CCC
CCCN1CCN(CCC)C2(COc3cccc(OC)c3C2)C1
CCCN1CCN(CCCCN2C(=O)CC3(CCCC3)CC2=O)CC11COc2cccc(OC)c2C1
CN(C)CC1CC2N(O1)c1cnccc1Cc1ccccc21
C[C@@H](C(c1ccc(cc1)O)O)N2CCC(CC2)Cc3ccccc3
CN(C)CCc1c[nH]c2ccc(CCN3CCNS3(=O)=O)cc12
CN(C)CCc1c[nH]c2ccc(cc12)N1CCN(Cc2ccccc2)S1(=O)=O
CN(C)CCc1c[nH]c2ccc(CN3CCN(Cc4ccc(NC(C)=O)cc4)S3(=O)=O)cc12
CN(C)CCc1c[nH]c2ccc(CCN3CCN(C)S3(=O)=O)cc12
CCN1CCN(CCc2ccc3[nH]cc(CCN(C)C)c3c2)S1(=O)=O
CN1CCN(Cc2ccc3scc(CCN)c3c2)S1(=O)=O
Clc1ccc(cc1)C1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Clc1cccc(c1)N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Fc1ccc(cc1)C1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Clc1ccc(cc1)N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
O=C1Nc2ccccc2C11CCN(CCN2CCN(CC2)c2ccccc2)C1
Clc1ccc(cc1Cl)N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Fc1ccc(cc1)N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Clc1ccc(OC2CCN(CCN3CCC4(C3)C(=O)Nc3ccccc43)CC2)cc1
Clc1ccc(cc1)C(=O)N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Clc1ccc(cc1)N1CCN(CCCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Fc1ccc(cc1)C1=CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1 |t:8|
Clc1ccccc1N1CCN(CCN2CCC3(C2)C(=O)Nc2ccccc32)CC1
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cncc4ccccc34)CC2)c1Cl
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cc4ccccc4cn3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cccc4cccnc34)CC2)c1Cl
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3ccc4cccnc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3ccc4ncccc4c3)CC2)c1Cl
Clc1ccc2ncc(cc2c1)S(=O)(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Clc1cccc(N2CCN(CCCCNS(=O)(=O)c3cnc4ccccc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCNS(=O)(=O)c3ccc4cccnc4c3)CC2)c1Cl
Clc1cccc(N2CCN(CCCNS(=O)(=O)c3ccc4ncccc4c3)CC2)c1Cl
Clc1ccc2ncc(cc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
CCNC(=O)N(CCCN(C)C)C(=O)[C@@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1 |r|
CN1CCC(CC1)c1cn(-c2ccc(F)cc2)c2ccc(cc12)-c1ncn(C)n1
CC(C)N(C[C@@H]1CNC[C@H]1Cc2ccccc2)C(=O)c3ccc(c(c3)OCCCOC)OC
CCc1cc2[C@H]3CNC[C@@H]3NC(=O)c2c(c1)C(F)(F)F |r|
Clc1ccc2[C@H]3CNC[C@@H]3NC(=O)c2c1Cl |r|
Cc1cccc2[C@H]3CNC[C@@H]3NC(=O)c12 |r|
Clc1cccc2[C@H]3CNC[C@@H]3NC(=O)c12 |r|
CC(C)c1cc(C)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
Cc1cc(cc2[C@H]3CNC[C@@H]3NC(=O)c12)C1CC1 |r|
CCc1cc(Cl)c2C(=O)N(C)[C@H]3CNC[C@@H]3c2c1 |r|
CCCc1cc(Cl)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
O=C1N[C@H]2CNC[C@@H]2c2ccccc12 |r|
FC(F)(F)c1cccc2[C@@H]3CNC[C@H]3NC(=O)c12 |r|
FC(F)(F)c1cccc2[C@H]3CNC[C@@H]3NC(=O)c12 |r|
CN1[C@H]2CNC[C@@H]2c2cccc(c2C1=O)C(F)(F)F |r|
Cc1ccc2[C@H]3CNC[C@@H]3NC(=O)c2c1Cl |r|
COc1ccc(-c2cc3[C@@H]4CNCC[C@@H]4N4CCCc(c2)c34)c(c1)C(F)(F)F |r|
C1C[C@H]2[C@@H](CN1)c1cccc3SCCCN2c13 |r|
CCc1cc2[C@H]3CNC[C@@H]3N(C)C(=O)c2c(c1)C(F)(F)F |r|
FC(F)(F)c1cccc2[C@@H]3CNC[C@@H]3NC(=O)c12 |r|
CCc1cc(Cl)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
CCc1ccc(Cl)c2C(=O)N[C@H]3CNC[C@@H]3c12 |r|
CCc1cc(C)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
Cc1cc(Cl)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
Cc1cc(C)c2C(=O)N[C@H]3CNC[C@@H]3c2c1 |r|
CN1C[C@@H]2[C@@H](C1)c1cc(Cl)ccc1Oc1ccccc21
Clc1cc2NC(=O)C3CNCCN3c2cc1Cl
Clc1cccc(COc2cncc(n2)N2CCNCC2)c1
C[C@H](N)Cn1ccc2cc(F)c(Cl)cc12 |r|
CCOc1noc2CCN(C)CCc12
COc1noc2CCN(C)CCc12
C(Oc1noc2CCNCCc12)c1ccccc1
CCOc1noc2CCNCCc12
COc1noc2CCNCCc12
CCn1oc2CCN(C)CCc2c1=O
CN1CCc2on(C)c(=O)c2CC1
O=c1c2CCNCCc2on1Cc1ccccc1
CCCn1oc2CCNCCc2c1=O
CCn1oc2CCNCCc2c1=O
Cn1oc2CCNCCc2c1=O
O=c1[n-]oc2CC[NH2+]CCc12
O=c1c2CNCCCc2on1Cc1ccccc1
O=c1c2CNCCc2on1Cc1ccccc1
CCn1oc2CCNCc2c1=O
Cn1oc2CCNCc2c1=O
CCOc1noc2CNCCc12
CCn1oc2CNCCc2c1=O
COc1cc2[C@@H]3Cc4ccc(O)c(OC)c4CN3CCc2cc1O
COc1c(O)ccc2C[C@@H]3N(CCc4cc5CCOc5cc34)Cc12 |r|
COc1c(O)ccc2C[C@@H]3N(CCc4cc5OCCOc5cc34)Cc12 |r|
Oc1ccc(cc1)N1CCN(Cc2cnn(c2)-c2ccc(Cl)cc2)CC1
FC(F)(F)c1cc(COCC2(CCNCC2)c2ccccc2)cc(c1)C(F)(F)F
CCc1cc(nc(n1)N1CCN(C)CC1)-c1ccoc1
CCCCc1cc(nc(n1)N1CCN(C)CC1)-c1ccoc1
CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccccc1
Clc1ccc(cc1)-c1noc2CCNCCc12
Clc1ccc(cc1)-c1n[nH]c2CCNCCc12
Fc1ccc(cc1)-c1n[nH]c2CCNCCc12
Fc1ccc(cc1)-c1noc2CCNCCc12
Cc1ccc(cc1)-c1noc2CCNCCc12
Cc1ccc(cc1)-c1n[nH]c2CCNCCc12
CN1CCN(CC1)c1ccc2CN(Cc2c1)C(=O)OCc1ccccc1
CCOC(=O)CCN1CCN(CC1)c1ccc2CCN(Cc2c1)C(=O)OCc1ccccc1
O=C(OCc1ccccc1)N1CCc2ccc(cc2C1)N1CCN(CC1)C1CCCC1
CC(C)c1ccccc1OCCCN1CCC(CC1)NS(=O)(=O)c1ccc(F)cc1
OC(COc1ccccc1-c1ccccc1)CN1CCC(CC1)NS(=O)(=O)c1cccc(Cl)c1
COc1ccc(cc1)N1CCN(CCNC(=O)c2ccccn2)CC1
Cc1cccc(N2CCN(CCNC(=O)c3ccccn3)CC2)c1C
Clc1ccccc1N1CCN(CCCNC(=O)c2ccccn2)CC1
Clc1ccc(cc1Cl)N1CCN(CCCNC(=O)c2ccccn2)CC1
O=C(NCCCN1CCN(CC1)c1ncccn1)c1ccccn1
Clc1ccc(cc1)C(N1CCN(CCCNC(=O)c2ccccn2)CC1)c1ccccc1
COc1ccccc1N1CCN(CCNC(=O)c2ccccn2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCNC(=O)c2ccccn2)CC1
O=C(NCCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccccn1
O=C(NCCCN1CCN(CC1)C(=O)c1ccco1)c1ccccn1
O=C(NCCN1CCN(CC1)c1ccccc1)c1ccccn1
CCOc1ccccc1N1CCN(CCNC(=O)c2ccccn2)CC1
O=C(NCCN1CCN(CC1)c1ccccc1C#N)c1ccccn1
Clc1ccccc1N1CCN(CCNC(=O)c2ccccn2)CC1
Clc1cccc(c1)N1CCN(CCNC(=O)c2ccccn2)CC1
Clc1ccc(cc1Cl)N1CCN(CCNC(=O)c2ccccn2)CC1
Fc1ccccc1N1CCN(CCNC(=O)c2ccccn2)CC1
Fc1ccc(cc1)N1CCN(CCNC(=O)c2ccccn2)CC1
O=C(NCCN1CCN(CC1)c1ccccn1)c1ccccn1
O=C(NCCN1CCN(CC1)c1ncccn1)c1ccccn1
O=C(NCCN1CCN(Cc2ccc3OCOc3c2)CC1)c1ccccn1
O=C(NCCN1CCN(CC1)C(=O)c1ccco1)c1ccccn1
Clc1ccc(cc1)C(N1CCN(CCNC(=O)c2ccccn2)CC1)c1ccccc1
Fc1ccc(cc1)C(N1CCN(CCNC(=O)c2ccccn2)CC1)c1ccc(F)cc1
O=C(NCCN1CCN(CC1)c1cccc2ccccc12)c1ccccn1
O=C(NCCCN1CCN(CC1)c1ccccc1)c1ccccn1
COc1ccccc1N1CCN(CCCNC(=O)c2ccccn2)CC1
COc1ccc(cc1)N1CCN(CCCNC(=O)c2ccccn2)CC1
CCOc1ccccc1N1CCN(CCCNC(=O)c2ccccn2)CC1
O=C(NCCCN1CCN(CC1)c1ccccc1C#N)c1ccccn1
CC(CNC(=O)c1ccccn1)N1CCN(CC1)c1cccc(c1)C(F)(F)F
Cc1cccc(N2CCN(CCCNC(=O)c3ccccn3)CC2)c1C
Clc1cccc(c1)N1CCN(CCCNC(=O)c2ccccn2)CC1
Clc1ccc(cc1)N1CCN(CCCNC(=O)c2ccccn2)CC1
Fc1ccccc1N1CCN(CCCNC(=O)c2ccccn2)CC1
Fc1ccc(cc1)N1CCN(CCCNC(=O)c2ccccn2)CC1
O=C(NCCCN1CCN(CC1)c1ccccn1)c1ccccn1
Fc1ccc(cc1)C(N1CCN(CCCNC(=O)c2ccccn2)CC1)c1ccc(F)cc1
O=C(NCCCN1CCN(CC1)c1cccc2ccccc12)c1ccccn1
CC(=O)c1c(OCCCCN2CCN(CC2)c2cc(C)cc(C)c2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2Cl)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2cc(C)cc(C)c2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2Br)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2cccc(F)c2)ccc2c(C)cc(=O)oc12
COc1ccccc1N1CCN(CCCOc2ccc3c(C)cc(=O)oc3c2C(C)=O)CC1
CC(=O)c1c(OCCCCN2CCN(CC2)c2cc(C)ccc2C)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2cccc(Br)c2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2cccc(F)c2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2cc(C)ccc2C)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccccc2Br)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCN2CCN(CC2)c2ccccc2C(F)(F)F)ccc2c(C)cc(=O)oc12
COc1ccccc1N1CCN(CCCCOc2ccc3c(C)cc(=O)oc3c2C(C)=O)CC1
CC(=O)c1c(OCCCN2CCN(CC2)c2cccc(Br)c2)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccccc2Cl)ccc2c(C)cc(=O)oc12
CC(=O)c1c(OCCCCN2CCN(CC2)c2ccccc2C(F)(F)F)ccc2c(C)cc(=O)oc12
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2cncc(c2)C(=O)NC2CC2)CC1
CCNC(=O)c1cncc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
CNC(=O)c1cncc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)ccn1
NC(=O)c1cc(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccn1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccn1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2cc(ccn2)C(=O)NC2CC2)CC1
CNC(=O)c1ccnc(OCCCCN2CCN(CC2)c2nsc3cc(F)ccc23)c1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)n1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2cccc3sccc23)n1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc3sc(F)cc23)ccn1
CNC(=O)c1cc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccn1
CNC(=O)c1cccc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)n1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccnc(c2)C(=O)NC2CC2)CC1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2ccc3ccsc3c2)n1
CCNC(=O)c1ccnc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
O=C(NC1CC1)c1cc(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccn1
CNC(=O)c1cncc(OCCCCN2CCN(CC2)c2nsc3cc(F)ccc23)c1
CNC(=O)c1cc(OCCCCN2CCN(CC2)c2cccc3sccc23)ccn1
CCNC(=O)c1cc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccn1
CNC(=O)c1ccnc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
CNC(=O)c1cccc(OCCCCN2CCN(CC2)c2nsc3cc(F)ccc23)n1
NCCCCCCn1cc(CCCCN2CCC(CC2)c2ccc(cc2)-c2cc(cc3cc(ccc23)-c2ccc(cc2)C(F)(F)F)C(O)=O)nn1
C[C@@H]1SC(=N[C@H]1[C@H]1SC[C@@](C)(N1C)C(O)=O)c1ccccc1O |r,c:3|
C[C@H]1SC(=N[C@@H]1CO)c1ccccc1O |r,c:3|
Oc1ccccc1C1=NC(Cc2c[nH]cn2)C(S1)c1ccccc1 |t:8|
C[C@@H]1SC(=N[C@H]1CO)c1ccccc1 |r,c:3|
COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1N=C(S[C@@H]1C)c1ccccc1O |r,c:16|
C[C@@H]1SC(=N[C@H]1CO)c1cccs1 |r,c:3|
C[C@@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccccc1O |r,c:3|
Oc1ccccc1C1=NC(Cc2c[nH]cn2)CS1 |t:8|
[H][C@]12CCC[C@@]1([H])N=C(S2)c1ccccc1O |r,c:8|
CNc1ccccc1C1=N[C@@H](CO)[C@H](C)S1 |r,t:9|
C[C@@H]1SC(=N[C@H]1CO)c1ccco1 |r,c:3|
C[C@@H]1SC(=N[C@H]1CO)c1ccsc1 |r,c:3|
CCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:12|
CCCCCCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:16|
C[C@@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccccc1 |r,c:3|
NC(=O)c1csc(n1)-c1ccccc1O
OC[C@@H]1CSC(=N1)c1ccccc1O |r,c:5|
Oc1ccccc1-c1nc(C=O)cs1
C[C@@H]1SC(=N[C@H]1CO)c1ccccc1O |r,c:3|
C[C@@H]1SC(=N[C@H]1CO)c1c[nH]c2ccccc12 |r,c:3|
C[C@@H]1SC(=N[C@@H]1CO)c1ccccc1O |r,c:3|
C[C@H]1SC(=N[C@H]1CO)c1ccccc1O |r,c:3|
NC(=O)C1CSC(=N1)c1ccccc1O |c:6|
C[C@@H]1SC(=N[C@H]1[C@@H]1SC[C@@](C)(N1C)C(O)=O)c1ccccc1O |r,c:3|
C[C@@H]1SC(=N[C@H]1CO)c1cc2ccccc2cc1O |r,c:3|
CCCCCCOc1ccc(cc1)C1=N[C@@H](CO)[C@H](C)S1 |r,t:14|
C[C@@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccc(cc1)-c1ccccc1 |r,c:3|
C[C@H]1SC(=N[C@H]1Cc1c[nH]cn1)c1ccc(cc1)-c1ccccc1 |r,c:3|
OCCOCCN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1
Cc1cc(C)c(OCCOCCN2CCN(Cc3ccccc3)CC2)c(C)c1
COc1ccccc1N1CCN(CCOCCOc2c(C)cc(C)cc2C)CC1
COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1
Cc1cc(C)c(C)c(OCCOCCN2CCN(CCO)CC2)c1
Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl
COc1ccccc1N1CCN(CCCOc2ccc(C)cc2C)CC1
COc1ccccc1N1CCN(CCOCCOc2c(C)cccc2C)CC1
COc1ccccc1N1CCN(CCCOc2c(C)cccc2C)CC1
Cc1cc(C)c(OCCOCCN2CCN(CCc3ccccc3)CC2)c(C)c1
Cc1cccc(OCCOCCN2CCN(CCc3ccccc3)CC2)c1C
COc1ccccc1N1CCN(CCCOc2c(C)cc(C)cc2C)CC1
Cc1cc(C)c(OCCOCCN2CCN(CCO)CC2)c(C)c1
COc1ccc(cc1)N1CCN(CCCOc2c(C)cc(C)cc2C)CC1
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(cc1)C(=O)OCC |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(cc1)-c1ccccc1 |r|
COc1cc2CCN3CC(CC(C)C)C(O)CC3c2cc1OC
CN1[C@@H](CCC[C@@H]1CC(=O)c2ccccc2)C[C@@H](c3ccccc3)O
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@H]1c1ccc(F)cc1 |r|
CCOC(=O)C1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CCC1c1ccc(F)cc1
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(cc1)C(F)(F)F |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(cc1)N(C)C |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1cccs1 |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(C)cc1 |r|
CCC1(O)CC2N(CCc3cc(OC)c(OC)cc23)CC1CC(C)C
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccccc1 |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1ccc(F)cc1 |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1cccc(c1)C(F)(F)F |r|
CCOC(=O)[C@@H]1CN(CCn2c(=O)[nH]c3ccccc3c2=O)CC[C@@H]1c1cccc2OCCOc12 |r|
[H][C@]12CCc3ccncc3N1CCNC2 |r|
[H][C@]12CCc3c(Br)ccnc3N1CCNC2 |r|
[H][C@]12CCc3cccnc3N1CCNC2 |r|
CCCCOc1c(cc(cc1OC)C(=O)NCC2(CCOCC2)N(C)C)OC
COc1c(OCCOCCOCCOCCOCCOc2cccc(C(=O)C3CCN(CCc4ccc(F)cc4)CC3)c2OC)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCC#C)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCOCCN=[N+]=[N-])cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCOCCOc2cn(CCOCCOc3cccc([C@H](O)C4CCN(CCc5ccc(F)cc5)CC4)c3OC)nn2)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCOCCOCCOCCOCCOCCOc2cccc(C(=O)C3CCN(CCc4ccc(F)cc4)CC3)c2OC)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2[nH]ccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1noc2ccccc12)c1cccc2cnccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2OCCOc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCCCC[C@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1ccnc2ccccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cncc2ccccc12 |r|
Clc1ccc2[nH]cc(C3=CCN(CC[C@@H]4CCCN4S(=O)(=O)c4cccc5ncccc45)CC3)c2c1 |r,t:8|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2cnccc12 |r|
Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc3ncccc23)CC1 |r|
Clc1ccc2[nH]cc(C3=CCN(CC[C@H]4CCCN4S(=O)(=O)c4cncc5ccccc45)CC3)c2c1 |r,t:8|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2OCCOc12)c1cccc2ncccc12 |r|
O=c1[nH]c2c(cccc2o1)N1CCN(CC[C@@H]2CCCN2S(=O)(=O)c2cccc3ncccc23)CC1 |r|
O=S(=O)(N1CCCCC[C@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2[nH]ccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCCCC[C@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCCC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCCC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCCC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1ccnc2ccccc12 |r|
O=S(=O)(N1CCCC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2[nH]ccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2cnccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2sccc12)c1cccc2cnccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1noc2ccccc12)c1cncc2ccccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1noc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2cnccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cncc2ccccc12 |r|
Fc1ccc2c(noc2c1)C1CCN(CC[C@@H]2CCCN2S(=O)(=O)c2cncc3ccccc23)CC1 |r|
Fc1ccc2c(noc2c1)C1CCN(CC[C@@H]2CCCN2S(=O)(=O)c2cccc3ncccc23)CC1 |r|
Clc1ccc2[nH]cc(C3=CCN(CC[C@H]4CCCN4S(=O)(=O)c4cccc5ncccc45)CC3)c2c1 |r,t:8|
Clc1ccc2[nH]cc(C3=CCN(CC[C@@H]4CCCN4S(=O)(=O)c4cncc5ccccc45)CC3)c2c1 |r,t:8|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2OCCOc12)c1cncc2ccccc12 |r|
O=c1[nH]c2c(cccc2o1)N1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cncc3ccccc23)CC1 |r|
O=c1[nH]c2c(cccc2o1)N1CCN(CC[C@@H]2CCCN2S(=O)(=O)c2cncc3ccccc23)CC1 |r|
O=S(=O)(N1CC[C@@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@@H]1CCN1CCN(CC1)c1cccc2OCCOc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCCCC[C@H]1CCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ncccc12 |r|
O=S(=O)(N1CCC[C@H]1CCN1CCN(CC1)c1cccc2[nH]ccc12)c1cncc2ccccc12 |r|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r,c:5|
Clc1ccc2C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)c2c1
[H][C@]12C[C@]([H])([C@H](O)[C@@H]1O)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4OCCOc34)C(=O)[C@@]21[H] |r,c:5|
Cc1ccc(cc1)C12CC1C(=O)N(CCCCN1CCN(CC1)c1cccc3sccc13)C2=O
O=C1N(CCCCN2CCN(CC2)c2cccc3sccc23)C(=O)c2ccccc12
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCN3CCC(CC3)c3noc4cc(F)ccc34)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@]21[H] |r|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r,c:5|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4sc(F)cc34)C(=O)[C@@]21[H] |r,c:5|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4ccsc34)C(=O)[C@@]21[H] |r,c:5|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3nsc4ccccc34)C(=O)[C@@]21[H] |r,c:5|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r,c:5|
CC1(C)C2C1C(=O)N(CCCCN1CCN(CC1)c1cccc3sccc13)C2=O
O=C1C2CCCC2C(=O)N1CCCCN1CCN(CC1)c1cccc2sccc12
O=C1C2CC=CCC2C(=O)N1CCCCN1CCN(CC1)c1cccc2sccc12 |c:4|
[H][C@]12C[C@]([H])([C@H](OC(C)=O)[C@@H]1OC(C)=O)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r|
Fc1ccc2C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)c2c1
Clc1cccc2C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)c12
CC1(C)CC(=O)N(CCCCN2CCN(CC2)c2cccc3sccc23)C(=O)C1
O=C1CC2(CCCCC2)CC(=O)N1CCCCN1CCN(CC1)c1cccc2sccc12
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1cccc2sccc12
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCN3CCN(CC3)c3ccc4ccsc4c3)C(=O)[C@]21[H] |r|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4scnc34)C(=O)[C@@]21[H] |r,c:5|
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCN3CCN(CC3)c3cccc4sccc34)C(=O)[C@@]21[H] |r,c:5|
O=C1C2CCCCC2C(=O)N1CCCCN1CCN(CC1)c1cccc2sccc12
Fc1cccc2C(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)C(=O)c12
CCC1(C)CC(=O)N(CCCCN2CCN(CC2)c2cccc3sccc23)C(=O)C1
[H][C@]12C[C@]([H])(C=C1)[C@@]1([H])C(=O)N(CCCCN3CCN(CC3)c3cccc4OC(F)(F)Oc34)C(=O)[C@@]21[H] |r,c:5|
OC1CC2C(CC1O)C(=O)N(CCCCN1CCN(CC1)c1cccc3sccc13)C2=O
OC1(CCN(CCCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
OC1(CCN(CCCCCc2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
OC1(CCN(CCCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
COc1ccc(cc1)N(CCCCN1CCC(O)(CC1)c1ccc(Cl)c(c1)C(F)(F)F)c1ccc(OC)cc1
[#8]C1([#6]-[#6]-[#7](-[#6]-[#6]-[#6]\[#6]=[#6](/c2ccc(F)cc2)-c2ccc(F)cc2)-[#6]-[#6]1)c1ccc(Cl)c(c1)C(F)(F)F
OC1(CCN(CCCN(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
OC1(CCN(CCCC(c2ccccc2)c2ccccc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
Fc1ccc2c(noc2c1)C1CCN(CCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1
O=C(CCN1CCN(CC1)c1ncccn1)c1cc2CCCN3C(=O)CCc(c1)c23
O=C1CCc2cc(CCCCN3CCN(CC3)c3nsc4ccccc34)cc3CCCN1c23
Fc1ccc2c(noc2c1)C1CCN(CCCC(=O)c2cc3CCC(=O)N4CCc(c34)c2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
Clc1ccc(cc1)N1CCN(CCC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCc2cc3CCCN4C(=O)CCc(c2)c34)CC1
Clc1cccc(N2CCN(CCC(=O)c3cc4CCN5c4c(CCC5=O)c3)CC2)c1Cl
Fc1ccc2c(noc2c1)C1CCN(CCCCCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1
CC1CC(=O)N2CCCc3cc(cc1c23)C(=O)CCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCCC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
Clc1cccc(N2CCN(CCCc3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1Cl
Clc1cccc(N2CCN(CCCCc3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1Cl
Fc1ccc2c(noc2c1)C1CCN(CCCCc2cc3CCCN4C(=O)CCc(c2)c34)CC1
OC(CCCN1CCC(CC1)c1noc2cc(F)ccc12)c1cc2CCCN3C(=O)CCc(c1)c23
Cc1cccc(N2CCN(CCC(=O)c3cc4CCN5c4c(CCC5=O)c3)CC2)c1C
Fc1cc(ccc1N1CCN(CCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1)C#N
Clc1cccc(N2CCN(CCCC(=O)c3cc4CCN5c4c(CCC5=O)c3)CC2)c1Cl
O=C(CCCN1CCN(CC1)c1nsc2ccccc12)c1cc2CCN3c2c(CCC3=O)c1
Fc1ccc2c(noc2c1)C1CCN(CCCC(=O)c2cc3CCN4c3c(CCC4=O)c2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCc2cc3CCN4c3c(CCC4=O)c2)CC1
OC(CCN1CCC(CC1)c1noc2cc(F)ccc12)c1cc2CCN3c2c(CCC3=O)c1
OC(CCCN1CCC(CC1)c1noc2cc(F)ccc12)c1cc2CCN3c2c(CCC3=O)c1
Clc1cccc(N2CCN(CCCC(=O)c3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1Cl
Cc1cccc(N2CCN(CCCC(=O)c3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1C
Fc1ccc2c(noc2c1)C1CCN(CCC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
O=C(CCN1CCC(CC1)c1nc2ccccc2s1)c1cc2CCCN3C(=O)CCc(c1)c23
O=C(CCN1CCN(CC1)c1nsc2ccccc12)c1cc2CCCN3C(=O)CCc(c1)c23
Cc1cccc(N2CCN(CCC(=O)c3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1C
COc1ccccc1N1CCN(CCC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
O=C(CCN1CCN(CC1)c1ccccc1)c1cc2CCCN3C(=O)CCc(c1)c23
Fc1ccc2c(noc2c1)C1CCN(CCCc2cc3CCN4c3c(CCC4=O)c2)CC1
O=C(CCCN1CCN(CC1)c1nsc2ccccc12)c1cc2CCCN3C(=O)CCc(c1)c23
Clc1cccc(N2CCN(CCC(=O)c3cc4CCCN5C(=O)CCc(c3)c45)CC2)c1Cl
O=C(CCN1CCN(CC1)c1ccccn1)c1cc2CCCN3C(=O)CCc(c1)c23
Fc1ccc2c(noc2c1)C1CCN(CC(=O)c2cc3CCCN4C(=O)CCc(c2)c34)CC1
CC1CC(=O)N2CCCc3cc(CCCCN4CCC(CC4)c4noc5cc(F)ccc45)cc1c23
O=C(CCN1CCN(CC1)c1nsc2ccccc12)c1cc2CCN3c2c(CCC3=O)c1
Fc1ccc2c(noc2c1)C1CCN(CCCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCCc2cc3CCN4c3c(CCC4=O)c2)CC1
OC(CCCCN1CCC(CC1)c1noc2cc(F)ccc12)c1cc2CCN3c2c(CCC3=O)c1
OC(CCN1CCC(CC1)c1noc2cc(F)ccc12)c1cc2CCCN3C(=O)CCc(c1)c23
Fc1ccc(cc1)C(=O)C1CCN(CCC2Cc3ccccc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2Cc3cc(F)ccc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2CCc3ccccc3C2=O)CC1
[H][C@@]12Cc3cn(C)c4cccc(C1=C[C@H](CN2C)C(=O)NC(CC)CO)c34 |c:13|
Fc1ccc(cc1)C(=O)C1CCN(CCC2CCCc3ccccc3C2=O)CC1
CCOC(=O)c1[nH]c2ccc(CCN3C(=O)CNC3=O)cc2c1CCN(C)C
C[C@@H](N)Cn1ccc2cc(F)c(Cl)cc12 |r|
CC(N)Cn1ccc2cc(Cl)c(F)cc12
CC(N)Cn1ccc2c(F)cccc12
COc1ccc2Cc3ccn(CC(C)N)c3-c2c1
CC(N)Cn1ccc2Cc3ccc(Br)cc3-c12
CC(N)Cn1ccc2c(C)cccc12
CC(N)Cn1ccc2c1-c1cc(C)ccc1C2(C)C
COc1cccc-2c1Cc1ccn(CC(C)N)c-21
C[C@@H](N)Cn1ccc2cc(F)c(F)cc12 |r|
CC(N)Cn1ccc2Cc3ccc(Cl)cc3-c12
CC(N)Cn1ccc2Cc3ccc(F)cc3-c12
COc1ccc-2c(Cc3ccn(CC(C)N)c-23)c1
CC(N)Cn1ccc2ccc(C)cc12
COc1cccc2Cc3ccn(CC(C)N)c3-c12
C[C@@H](N)Cn1ccc2c(Cl)c(F)ccc12 |r|
COc1ccc2Cc3ccn(C[C@H](C)N)c3-c2c1 |r|
CC(N)Cn1ccc2ccc(F)cc12
C[C@H](N)Cn1ccc2c(Cl)c(F)ccc12 |r|
COc1ccc2c(c1)-c1c(ccn1CC(C)N)C2(C)C
CC(N)Cn1ccc2Cc3ccc(C)cc3-c12
CC(N)Cn1ccc2c1-c1cc(F)ccc1C2(C)C
COc1ccc2Cc3ccn(C[C@@H](C)N)c3-c2c1 |r|
Cc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1
Clc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1
Oc1ccc2nc(N3CCNCC3)n(Cc3ccccc3)c2c1
COc1ccc2nc(N3CCNCC3)n(Cc3ccccc3)c2c1
Cn1c(nc2ccccc12)N1CCNCC1
Oc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1
CCn1c(nc2ccccc12)N1CCNCC1
COc1cccc2nc(N3CCNCC3)n(Cc3ccccc3)c12
C(c1ccccc1)n1c(nc2ccccc12)N1CCNCC1
CCCn1c(nc2ccccc12)N1CCNCC1
Cc1cc2nc(N3CCNCC3)n(Cc3ccccc3)c2cc1C
Clc1cc2nc(N3CCNCC3)n(Cc3ccccc3)c2cc1Cl
Fc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1
COc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1
COc1cccc2n(Cc3ccccc3)c(nc12)N1CCNCC1
C1CC1n1c(nc2ccccc12)N1CCNCC1
CN(C)c1ccc2N(CCc2c1)C(=O)Nc1cccnc1
CSc1ccc2N(CCc2c1)C(=O)Nc1cccnc1
FC(F)(F)c1ccc2CCN(C(=O)Nc3cccnc3)c2c1
CC(C)Sc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
Clc1cccc2N(CCc12)C(=O)Nc1cccnc1
[O-][N+](=O)c1cc(Br)cc2CCN(C(=O)Nc3cccnc3)c12
[O-][N+](=O)c1ccc2N(CCc2c1)C(=O)Nc1cccnc1
Clc1cc2N(CCc2cc1-c1ccccc1)C(=O)Nc1cccnc1
COc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)C(F)(F)F
FC(F)(F)c1cc2N(CCc2cc1OCC1CC1)C(=O)Nc1cccnc1
CCOc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CC(C)(C)c1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CC(C)c1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
O=C(Nc1cccnc1)N1CCc2cc(ccc12)-c1ccccc1
COC(=O)c1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CC(C)c1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1OC(F)(F)F
CSc1c(Cl)cc2N(CCc2c1Cl)C(=O)Nc1cccnc1
Cc1c(Cl)cc2N(CCc2c1Cl)C(=O)Nc1cccnc1
CC(C)(C)c1ccc2N(CCc2c1Cl)C(=O)Nc1cccnc1
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1I
CCCc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CSc1cc2N(CCc2cc1Br)C(=O)Nc1cccnc1
CCOc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
CCc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CC(C)c1ccc2N(CCc2c1)C(=O)Nc1cccnc1
CSc1ccc2N(CCc2c1Cl)C(=O)Nc1cccnc1
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)C(F)(F)F
FC(F)(F)c1ccc2N(CCc2c1)C(=O)Nc1cccnc1
Cc1ccc2N(CCc2c1)C(=O)Nc1cccnc1
CC(C)Oc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C#N
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Br
CC(=O)c1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
COc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Br
CCSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
CC(C)Oc1cc2CCN(C(=O)Nc3cccnc3)c2cc1Cl
FC(F)(F)c1cc2N(CCc2cc1Cl)C(=O)Nc1cccnc1
CCCSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F
COc1ccccc1N1CCN(CCC2CCc3ccccc3C2=O)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC2Cc3sccc3C(=O)C2)CC1
COc1ccccc1N1CCN(CC2Cc3sccc3C(=O)C2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2Cc3sccc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CC2CC(=O)c3ccccc23)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CCC2CCc3ccccc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2CCc3sccc3C2=O)CC1
COc1ccccc1N1CCN(CCC2CCc3sccc3C2=O)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CCC2CCc3sccc3C2=O)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CCC2Cc3ccccc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CC2Cc3sccc3C(=O)C2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCC2CCc3ccsc3C2=O)CC1
Fc1ccc(cc1)C(=O)C1CCN(CC2Cc3sccc3C(=O)C2)CC1
COc1ccccc1N1CCN(CC2CC(=O)c3ccccc23)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC2CC(=O)c3ccccc23)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC2CC(=O)c3ccccc3C2)CC1
Fc1ccc(cc1)C(=O)C1CCN(CCC2CCc3ccsc3C2=O)CC1
Fc1ccc(cc1)C(=O)CCCN1CCN(CCC2Cc3sccc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CCC2CCc3sccc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CCC2Cc3sccc3C2=O)CC1
COc1cccc(OC)c1OCCNCC1C(Cc2ccccc2C1=O)c1ccccc1
COc1cccc(OC)c1OCCNCC1COc2ccccc2O1
COc1cccc(OC)c1OCCNCC1Oc2ccccc2CC1c1ccccc1
COc1cccc(OC)c1OCCNCC1C(Oc2ccccc2C1=O)c1ccccc1
Fc1ccc(cc1)C(=O)C1CCN(CCC2CC3=CC=CC3C2=O)CC1 |c:20,t:18|
Fc1ccc2c(noc2c1)C1CCN(CCC2CCc3ccsc3C2=O)CC1
Fc1ccc2c(noc2c1)C1CCN(CCC2CC3=CC=CC3C2=O)CC1 |c:22,t:20|
Fc1ccc(cc1)C(=O)CCCN1CCN(CCC2CC3=CC=CC3C2=O)CC1 |c:23,t:21|
CN(C)[C@H]1C[C@@H](C1)c1c[nH]c2ccc(CC3COC(=O)N3)cc12 |wU:3.2,wD:5.7,(12.22,-9.08,;13.25,-7.93,;14.76,-8.24,;12.76,-6.47,;11.38,-5.77,;12.08,-4.41,;13.46,-5.09,;11.59,-2.95,;12.5,-1.69,;11.59,-.45,;10.13,-.94,;8.79,-.17,;7.46,-.94,;7.46,-2.48,;6.12,-3.25,;6.12,-4.79,;4.88,-5.7,;5.36,-7.16,;6.9,-7.17,;7.98,-8.25,;7.37,-5.7,;8.79,-3.25,;10.13,-2.48,)|
[H][C@@]12Cc3c[nH]c4cccc(C1=C[C@H](CN2C)C(=O)N[C@]1(C)O[C@@]2(O)[C@H](Cc5ccccc5)NC(=O)[C@H](CC(C)C)N2C1=O)c34 |c:12|
NCCCC1(CCCN)CCc2cccc(O)c2C1
CN(C)CCN(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)C(=O)CCC1CCCC1
O=C(C=Cc1ccccc1)N(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)Cc1cccnc1
CN(C)CCN(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)C(=O)C=Cc1ccccc1
Cc1ccc2c(OCCN3CCN(Cc4cccc5cccnc45)CC3)cccc2n1
CC(C)(CCCN1CCCC(C1)c1ccccc1)S(=O)(=O)c1ccccc1
O=S(=O)(c1ccccc1)C1(CCCN2CCC3CCCCC3C2)CCC1
CC(C)(CCCN1CC[C@@H]2CCCC[C@H]2C1)S(=O)(=O)c1ccccc1
CC(C)(CCCN1CCCC(C1)c1cnco1)S(=O)(=O)c1ccccc1
CCOC(=O)[C@@H]1CCCN(CCCC(C)(C)S(=O)(=O)c2ccccc2)C1
CC(C)(CCCN1CCCC(C1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCCC1 |t:23|
O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2o1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1cccs1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccccc1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCCCC1 |t:23|
CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1CCCC1
Fc1ccc(cc1)-c1cncc(CNC[C@H]2CCc3ccccc3O2)c1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccco1
Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2cccc3OCCOc23)c1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccsc1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1CC1
CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCC1 |t:23|
Fc1ccc(cc1)C(=O)CCCCN1CCN(CC2CC(=O)NN=C2c2ccccc2)CC1 |c:24|
COc1cc2CC(CN3CCC4(CC3)NC(=O)NC4=O)CC(=O)c2cc1OC
Fc1ccc(cc1)C(=O)CCCN1CCN(CC2CC(=O)NN=C2c2ccccc2)CC1 |c:23|
Fc1ccc2c(noc2c1)C1CCN(CC2CC(=O)NN=C2c2ccccc2)CC1 |c:22|
O=C1NCNC11CCN(CC2CC(=O)c3ccccc3C2)CC1
CCCCCc1cc2c(CC(CCN3CCC(CC3)c3noc4cc(F)ccc34)CC2=O)s1
Fc1ccc(cc1)C(=O)N1CCN(CCC2CCc3occc3C2=O)CC1
COc1ccc(cc1OCCN1CCCCCC1)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1[C@@H](C)CCC[C@H]1C)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cccc(C#N)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)c(Cl)c(C)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(F)cc(c2C1=O)C(F)(F)F
COc1ccc(cc1OCCN1CCCCC1)N1Cc2cccc(F)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)c(C)c(Cl)c2C1=O
COc1ccc(cc1OCCN1CCCCC1C)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1cccc2CN(C(=O)c12)c1ccc(OC)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2ccc(Cl)cc2C1=O
COc1ccc(cc1OCCN1CCCC(C)C1)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCCCC1)N1Cc2cccc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCCCC1)N1Cc2ccc(Cl)cc2C1=O
COc1ccc(cc1OCCN1CCOCC1)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(C)cc(C)c2C1=N
COc1ccc(cc1OCCN1CCC(C)(C)CC1)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2ccc(Cl)c(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)c(Cl)cc2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(C)cc(C)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1C(C)c2cccc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cccc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cccc(c2C1=O)C(F)(F)F
COc1ccc(cc1OCCN1CCCCC1)N1Cc2ccccc2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cccc(C)c2C1=O
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(cccc2Cl)C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)cc(Cl)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cccc(Br)c2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(cccc2Cl)C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c(ccc2F)C(F)(F)F
COc1ccc(cc1OCCN1CCCCC1)N1Cc2cc(Cl)ccc2C1=O
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c(Cl)cc(F)c2F
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)ccc2C1=O
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(C1=O)c1cc(Cl)ccc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c1ccc(Cl)cc1n2C
COc1ccc2n(C)c3CN(C(=O)c3c2c1)c1ccc(OC)c(OCCN2CCCCC2)c1
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(C1=O)c1cc(Cl)c(Cl)cc1n2C
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(C1=O)c1ccc(Cl)cc1n2C
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(C1=O)c1ccccc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1C(O)c2c(C1=O)c1ccccc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c1cccc(F)c1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2sc3ccccc3c2C1=O
COc1ccc(cc1OCCN1CCCCC1)N1Cc2c(C1=O)c1ccc(F)cc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c1ccc(F)cc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c1cc(Cl)ccc1n2C
COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2c(C1=O)c1cc(F)ccc1n2C
COc1ccc(cc1OCCN1CCCCC1)N1Cc2sc3ccccc3c2C1=O
Fc1ccc2[nH]cc(C3=CCN(CCCCN4C(=O)c5ccccc5C4=O)CC3)c2c1 |t:8|
C[C@H]1Oc2c(NC1=O)cccc2N1CCN(CCCc2c[nH]c3ccc(F)cc23)CC1
Fc1ccc(cc1)C(=O)CCCN1C2CN3CCNCC3CC2c2ccccc12
Fc1ccc(cc1)C(=O)CCCN1CCN2CC3Nc4ccccc4C3CC2C1
Fc1ccc(cc1)C(=O)CCCN1CCN2Cc3[nH]c4ccccc4c3CC2C1
Fc1ccc(cc1)C(=O)CCCN1C2CN3CCN(CCCC(=O)c4ccc(F)cc4)CC3CC2c2ccccc12
COc1ccccc1N1CCN(CCCOc2ccc3[nH]cnc3c2)CC1
COc1ccccc1N1CCN(CCCOc2ccc3[nH]c(=S)[nH]c3c2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCOc2ccc3[nH]cnc3c2)CC1
S=c1[nH]c2ccc(OCCCN3CCN(CC3)c3ccccc3)cc2[nH]1
FC(F)(F)c1cccc(c1)N1CCN(CCCOc2ccc3[nH]c(=S)[nH]c3c2)CC1
C(COc1ccc2[nH]cnc2c1)CN1CCN(CC1)c1ccccc1
Cc1ccc2c(OCCN3CCC(Cc4cc5NC(=O)COc5cc4F)CC3)cc(F)cc2n1
Cc1ccc2c(OCCN3CCC(Cc4ccc5OCC(=O)Nc5c4F)CC3)cc(Cl)cc2n1
Cc1ccc2c(OCCN3CCC(Cc4ccc5OCC(=O)Nc5c4F)CC3)cc(F)cc2n1
Cc1ccc2c(OCCN3CCC(Cc4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
Cc1ccc2c(OCCN3CCC(Cc4cc(F)c5OCC(=O)Nc5c4)CC3)cc(F)cc2n1
Cc1ccc2c(OCCN3CCC(Cc4cc(F)c5OCC(=O)Nc5c4)CC3)cc(Cl)cc2n1
Cc1ccc2c(OCCN3CCC(Cc4cc5NC(=O)COc5cc4F)CC3)cc(Cl)cc2n1
Fc1ccc(cc1)C(=O)C1CCN(CC2Cc3[nH]ncc3C(=O)C2)CC1
Fc1ccc2c(noc2c1)C1CCN(CC2Cc3[nH]ncc3C(=O)C2)CC1
Cn1ncc2c1CC(CN1CCC(CC1)C(=O)c1ccc(F)cc1)CC2=O
Cc1noc2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c12
Cn1ncc2c1CC(CN1CCC(CC1)c1noc3cc(F)ccc13)CC2=O
Cc1noc2CC(CN3CCC(CC3)C(=O)c3ccc(F)cc3)CC(=O)c12
CC[C@H]1CNCCc2ccc(Cl)cc12
COc1cc2C(C)CNCCc2cc1Cl
CC[C@@H]1CNCCc2ccc(Cl)cc12
C[C@H]1CNCCc2ccc(cc12)C(F)(F)F
C1Cc2ccccc2CCN1
COc1cc2CCNC[C@H](C)c2cc1Cl
C[C@@H]1CNCCc2ccc(Cl)c(F)c12
C[C@@H]1CNCCc2cc(Cl)c(Cl)cc12
C[C@@H]1CNCCc2ccc(cc12)C(F)(F)F
COc1cc2CCNC[C@@H](C)c2cc1Cl
C[C@H]1CNCCc2cc(Cl)c(Cl)cc12
CC1(C)CNCCc2ccc(Cl)cc12
OC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
COC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
Cn1c(nc2n(C)c(=O)n(C)c(=O)c12)N1CCN(CC1)C(c1ccccc1)c1ccccc1
COc1ccccc1N1CCN(CCCNc2nc3n(C)c(=O)n(C)c(=O)c3n2Cc2ccccc2)CC1
Cn1c2nc3N(CCCN4CCN(CC4)c4cccc(Cl)c4)C(=O)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCN4CCN(CC4)c4ncccn4)C(=O)CCCn3c2c(=O)n(C)c1=O
Cn1c(NCCCN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
Cn1c2nc3N(CCCN4CCN(CC4)c4ccccc4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3n(CCCCN4CCN(CC4)c4ccccc4)c(=O)ccn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCN2c3nc4n(C)c(=O)n(C)c(=O)c4n3CCC2=O)CC1
Cn1cnc2n(C)c(=O)n(CCCN3CCN(CC3)C(c3ccccc3)c3ccccc3)c(=O)c12
Cn1c2nc3n(CCCCN4CCN(CC4)c4cccc(Cl)c4)c(=O)ccn3c2c(=O)n(C)c1=O
Cn1c2nc(NCCCN3CCN(CC3)c3cccc(Cl)c3)n(CCCc3ccccc3)c2c(=O)n(C)c1=O
Cn1c2nc(NCCCN3CCN(CC3)c3cccc(Cl)c3)n(CCc3ccccc3)c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCNc2nc3n(C)c(=O)n(C)c(=O)c3n2CCCc2ccccc2)CC1
CC(c1ccccc1)n1c(NCCCN2CCN(CC2)c2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
CCOC(=O)Cn1c(NCCCN2CCN(CC2)c2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
Cn1c(NCCCN2CCN(CC2)c2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
COc1ccccc1N1CCN(CCCN2c3nc4n(C)c(=O)n(C)c(=O)c4n3CCCC2=O)CC1
COc1ccccc1N1CCN(CCCN2CCCCn3c2nc2n(C)c(=O)n(C)c(=O)c32)CC1
Cn1c2nc3N(CCCN4CCN(CC4)c4cccc(Cl)c4)CCCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCN4CCN(CC4)c4cccc(Cl)c4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCN4CCN(CC4)c4ncccn4)C(=O)CCn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCN4CCN(CC4)c4ccccc4)CCCCn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCCCn2c3nc4n(C)c(=O)n(C)c(=O)c4n3ccc2=O)CC1
Cn1c2nc(NCCCN3CCN(CC3)c3ccccc3)n(CCCc3ccccc3)c2c(=O)n(C)c1=O
CCCCn1c(NCCCN2CCN(CC2)c2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
Cn1c2nc3N(CCCN4CCN(CC4)c4ncccn4)CCCn3c2c(=O)n(C)c1=O
Cn1c2nc3n(CCCN4CCN(CC4)c4cccc(Cl)c4)c(=O)ccn3c2c(=O)n(C)c1=O
Cn1c2nc3N(CCCN4CCN(CC4)c4cccc(Cl)c4)C(=O)CCn3c2c(=O)n(C)c1=O
COc1ccccc1N1CCN(CCc2ccc3[nH]nnc3c2)CC1
C(Cc1ccc2[nH]c(nc2c1)-c1ccccc1)N1CCN(CC1)c1ccccc1
FC(F)(F)c1cccc(c1)N1CCN(CCc2ccc3[nH]c(=O)c(=O)[nH]c3c2)CC1
[O-][N+](=O)c1ccc(CCN2CCN(CC2)c2ccccc2)cc1[N+]([O-])=O
C(Cc1ccc2[nH]cnc2c1)N1CCN(CC1)c1cccc2ccccc12
C(Cc1ccc2nn[nH]c2c1)N1CCN(CC1)c1cccc2ccccc12
Cc1cccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)c1C
[H][C@@]12CNCCN1C(=O)c1cccc(OC)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cccc(CC)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(OC)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(cc1C2)C(F)(F)F |r|
[H][C@@]12CNCCN1C(=O)c1ccc(CC)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(C)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cc(ccc1C2)C(F)(F)F |r|
[H][C@@]12CNCCN1C(=O)c1cc(CC)ccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(C2)cccc1C(F)(F)F |r|
[H][C@@]12CNCCN1C(=O)c1c(C2)cccc1C1CC1 |r|
[H][C@@]12CNCCN1C(=O)c1c(C)cccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccccc1[C@H]2C |r|
[H][C@@]12CNC[C@@H](C)N1C(=O)c1ccccc1C2 |r|
C[C@@]12CNCCN1C(=O)c1ccccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cccc(OCC)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cccc(C)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(cc1C2)C#N |r|
[H][C@@]12CNCCN1C(=O)c1ccc(Cl)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cc(ccc1C2)C#N |r|
[H][C@@]12CNCCN1C(=O)c1cc(OC)ccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(C2)cccc1C#N |r|
[H][C@@]12CNCCN1C(=O)c1c(C2)cccc1OC |r|
[H][C@@]12CNCCN1C(=O)c1c(CC)cccc1C2 |r|
[H][C@@]12CNC[C@H](C)N1C(=O)c1ccccc1C2 |r|
[H][C@@]12CN[C@@H](C)CN1C(=O)c1ccccc1C2 |r|
[H][C@@]12CN(C)CCN1C(=O)c1ccccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc3CCCOc3c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(C)cc(CC)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(C)cc(C)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(C)c(OC)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cc(Cl)ccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cc(C)ccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccc(CCC)cc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cccc(OCCC)c1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(C)ccc(OC)c1C2 |r|
[H][C@@]12CN[C@H](C)CN1C(=O)c1ccccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1c(Cl)cccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1ccccc1C2 |r|
[H][C@@]12CNCCN1C(=O)c1cccc(c1C2)C(F)(F)F |r|
Clc1ccc(cc1)-n1cc(CCCCCN2CCN(CC2)c2ccccc2)cn1
Clc1ccc(cc1)-n1cc(CCCN2CCN(CC2)c2ccccc2)cn1
Clc1ccc(cc1)-n1cc(CCCCN2CCN(CC2)c2ccccc2)cn1
Clc1ccc(cc1)-n1cc(COCCN2CCN(CC2)c2ccccc2)cn1
Clc1ccc(cc1)-n1cc(COCCCN2CCN(CC2)c2ccccc2)cn1
Clc1ccc(cc1)N1CCN(CCCc2ccccc2)CC1
Clc1ccc(cc1)N1CCN(CCc2ccccc2)CC1
Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Clc1cccc(c1)N1CCN(CCc2ccccc2)CC1
Clc1cccc(c1)N1CCN(CCCc2ccccc2)CC1
C(CN1CCN(CC1)c1ccccn1)Cc1ccccc1
Clc1ccccc1N1CCN(CCCc2ccccc2)CC1
[#7][#6](-[#7])=[#7][#6](=O)-c1ccc2-c3ccccc3C3([#6]-[#6]-[#6]-[#8]3)c2c1
CB1Nc2cccc(OCC(O)CN(C)C)c2C=C1 |c:18|
CB1Nc2c(OCC(O)CN(C)C)cccc2C=C1 |c:18|
FC(F)(F)c1cccc(c1)N1CCN(CCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
O=C1N(CCCCCCN2CCN(CC2)c2ccccn2)S(=O)(=O)c2ccccc12
Clc1cccc(c1)N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
O=C1N(CCCCCCN2CCN(CC2)c2nsc3ccccc23)S(=O)(=O)c2ccccc12
O=C1N(CCCCCCN2CCN(CC2)c2ncccn2)S(=O)(=O)c2ccccc12
O=C1N(CCCCCCN2CCN(CC2)c2cccc3ccccc23)S(=O)(=O)c2ccccc12
O=C1N(CCCCCCN2CCN(CC2)c2ccccc2)S(=O)(=O)c2ccccc12
COc1cccc(c1)N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1ccc(cc1Cl)N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Fc1ccccc1N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
O=C1N(CCCCCCN2CCN(CC2)c2cccc3cccnc23)S(=O)(=O)c2ccccc12
FC(F)(F)c1cccc(c1)N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1ccccc1N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
FC(F)(F)c1ccccc1N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1cccc(N2CCN(CCCCCCN3C(=O)c4ccccc4S3(=O)=O)CC2)c1Cl
CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N |r|
CC[C@H]1c2ccccc2N(C[C@@]1(C)N)c1ccccc1 |r|
CC[C@H]1c2cc(C)ccc2OC[C@@]1(C)N |r|
Fc1ccc2[nH]cc(C3CC(=O)N(CCCCN4CCC(CC4)c4c[nH]c5ccccc45)C3=O)c2c1
COc1ccc2[nH]cc(C3CCN(CCCCN4C(=O)CC(C4=O)c4c[nH]c5ccccc45)CC3)c2c1
COc1ccc2[nH]cc(C3CCN(CCCCN4C(=O)CC(C4=O)c4c[nH]c5ccc(F)cc45)CC3)c2c1
COc1ccc2[nH]cc(C3CC(=O)N(CCCCN4CCC(CC4)c4c[nH]c5ccc(OC)cc45)C3=O)c2c1
COc1ccc2[nH]cc(C3CC(=O)N(CCCCN4CCC(CC4)c4c[nH]c5ccc(F)cc45)C3=O)c2c1
Fc1ccc2[nH]cc(C3CCN(CCCCN4C(=O)CC(C4=O)c4c[nH]c5ccccc45)CC3)c2c1
COc1ccc2[nH]cc(C3CC(=O)N(CCCCN4CCC(CC4)c4c[nH]c5ccccc45)C3=O)c2c1
Fc1ccc2[nH]cc(C3CC(=O)N(CCCCN4CCC(CC4)c4c[nH]c5ccc(F)cc45)C3=O)c2c1
COc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1
COc1ccc2[nH]c(C)c(CCNCc3ccc(o3)-c3ccc(O)cc3)c2c1
C(Cc1c[nH]c2ccccc12)NCc1ccc(o1)-c1ccccc1
COc1cccc(c1)-c1ccc(CNCCc2c[nH]c3ccc(OC)cc23)o1
COc1ccc2[nH]cc(CCNCc3ccc(o3)-c3cccc(O)c3)c2c1
COc1ccc2[nH]cc(CCNCc3ccc(o3)-c3ccc(Cl)cc3)c2c1
Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ccccc23)o1
COc1ccc2[nH]cc(CCNCc3ccc(o3)-c3ccc(O)cc3)c2c1
Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ccc(F)cc23)o1
Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3cc(F)ccc23)o1
Cc1ccc2[nH]cc(CCNCc3ccc(o3)-c3ccc(O)cc3)c2c1
FC(F)C(F)(F)COc1cccc(CNCCc2c[nH]c3cc(F)ccc23)c1
COc1ccc2[nH]cc(CCNCc3ccc(o3)-c3cnc4ccccc4c3)c2c1
COc1cccc2[nH]cc(CCNCc3ccc(o3)-c3ccc(O)cc3)c12
Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ccc(Cl)cc23)o1
CN(CCc1c[nH]c2ccccc12)Cc1ccc(o1)-c1ccccc1
COc1ccc2[nH]cc(CCNCc3ccc(o3)-c3cn[nH]c3)c2c1
Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ncc(F)cc23)o1
COc1ccccc1N1CCN(CCCNC(=O)NN(Cc2ccc(F)cc2)c2ccccc2)CC1
COc1ccccc1N1CCN(CCCNC(=O)NN(Cc2ccccc2)c2ccccc2)CC1
COc1ccc2n(cc(-c3[nH]c(NC(C)=O)nc3C)c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(NC(C)=O)nc3C)c2c1)S(=O)(=O)c1cccc(F)c1
CCC(=O)Nc1nc(C)c([nH]1)-c1ccc2ccn(c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3nc(N)sc3C)c2c1)S(=O)(=O)c1ccccc1
CC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
Nc1ncc([nH]1)-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
CCc1nc(N)[nH]c1-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3cnc(N)[nH]3)c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(N)nc3C)c2c1)S(=O)(=O)c1cccc(F)c1
Cc1nc(N)[nH]c1-c1cn(c2ccccc12)S(=O)(=O)c1cccc2ccccc12
COc1ccc2n(cc(-c3[nH]c(N)nc3C)c2c1)S(=O)(=O)c1ccc2ccccc2c1
Cc1nc(N)[nH]c1-c1ccc2ccn(c2c1)S(=O)(=O)c1ccccc1
CCc1nc(NC(C)=O)[nH]c1-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(NC(=O)Cc4ccccc4)nc3C)c2c1)S(=O)(=O)c1ccccc1
CC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccc(F)cc12)S(=O)(=O)c1ccccc1
CCC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccc(F)cc12)S(=O)(=O)c1ccccc1
CCC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccccc12)S(=O)(=O)c1cccc2ccccc12
COc1ccc2n(cc(-c3[nH]c(NC(C)=O)nc3C)c2c1)S(=O)(=O)c1cccc2ccccc12
CCC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccc2ccccc2c1
CCC(=O)Nc1nc(C)c([nH]1)-c1cccc2n(ccc12)S(=O)(=O)c1ccccc1
CC(=O)N1CCCn2c1nc(C)c2-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1 |(12.77,-3.16,;11.24,-3.01,;10.6,-1.6,;10.34,-4.26,;8.81,-4.11,;7.92,-5.36,;8.56,-6.76,;10.08,-6.9,;10.98,-5.65,;12.45,-6.12,;12.46,-7.66,;13.71,-8.56,;11,-8.14,;10.53,-9.61,;11.45,-10.85,;10.55,-12.11,;9.08,-11.64,;7.74,-12.42,;6.4,-11.65,;6.41,-10.1,;7.73,-9.33,;9.07,-10.1,;11.03,-13.56,;12.51,-13.16,;12.12,-14.65,;10.01,-14.72,;8.51,-14.4,;7.48,-15.55,;7.97,-17.02,;9.48,-17.32,;10.5,-16.17,)|
O=S(=O)(c1ccccc1)n1cc(-c2c[n+]3cccnc3[nH]2)c2ccccc12
COc1ccc2n(cc(-c3[nH]c4cccc[n+]4c3C)c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(NCC(F)F)nc3C)c2c1)S(=O)(=O)c1ccccc1
CC(=O)Nc1nc(C)c([nH]1)-c1ccc2ccn(c2c1)S(=O)(=O)c1ccccc1
Cc1nc(N)[nH]c1-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(N)nc3C)c2c1)S(=O)(=O)c1ccccc1
Nc1ncc([nH]1)-c1cccc2n(ccc12)S(=O)(=O)c1ccccc1
CCc1nc(NC(C)=O)[nH]c1-c1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3cnc(NC(C)=O)[nH]3)c2c1)S(=O)(=O)c1cccc(F)c1
COc1ccc2n(cc(-c3[nH]c(NC(C)=O)nc3C)c2c1)S(=O)(=O)c1ccc2ccccc2c1
COc1ccc2n(cc(-c3nc4NCCCn4c3C)c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3c(C)nc(N)n3CC(F)F)c2c1)S(=O)(=O)c1ccccc1 |(43.73,-8.06,;45.07,-7.29,;46.4,-8.06,;46.4,-9.6,;47.73,-10.37,;49.07,-9.59,;50.54,-10.06,;51.44,-8.81,;50.53,-7.57,;50.99,-6.1,;52.45,-5.61,;53.7,-6.51,;52.44,-4.08,;50.97,-3.6,;50.49,-2.14,;50.08,-4.85,;48.54,-4.86,;47.76,-3.53,;46.22,-3.54,;48.52,-2.19,;49.06,-8.05,;47.73,-7.29,;51.02,-11.52,;52.51,-11.11,;52.11,-12.6,;50,-12.67,;48.5,-12.36,;47.47,-13.51,;47.96,-14.97,;49.48,-15.28,;50.49,-14.13,)|
CCC(=O)Nc1nc(C)c([nH]1)-c1cn(c2ccc(OC)cc12)S(=O)(=O)c1cccc(F)c1
CCc1nc(N)[nH]c1-c1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccccc1
CC(=O)N1CCn2c1nc(C)c2-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1 |(71.4,-24.98,;69.89,-25.31,;68.85,-24.18,;69.43,-26.78,;67.97,-27.27,;67.99,-28.81,;69.46,-29.27,;70.35,-28.02,;71.83,-28.49,;71.83,-30.03,;73.09,-30.93,;70.37,-30.51,;69.91,-31.98,;70.82,-33.22,;69.92,-34.48,;68.45,-34.01,;67.11,-34.79,;65.78,-34.02,;65.78,-32.47,;67.11,-31.7,;68.45,-32.47,;70.4,-35.93,;71.89,-35.53,;71.5,-37.02,;69.39,-37.09,;67.88,-36.77,;66.86,-37.92,;67.34,-39.38,;68.86,-39.69,;69.87,-38.54,)|
COc1ccc2n(cc(-c3[nH]c(N)nc3C)c2c1)S(=O)(=O)c1cccc2ccccc12
COc1ccc2n(cc(-c3[nH]c4nccc[n+]4c3C)c2c1)S(=O)(=O)c1ccccc1
COc1ccc2n(cc(-c3[nH]c(NCCc4ccccc4)nc3C)c2c1)S(=O)(=O)c1ccccc1
NC[C@@H]1C[C@@]1(F)c1ccccc1
COc1ccccc1CNC[C@H]1C[C@]1(F)c1ccccc1
COc1ccccc1CNCC1CC1(F)c1cc(F)ccc1OC
NC[C@H]1C[C@]1(F)c1cccc(Cl)c1
NCC1C(c2ccccc2)C1(F)F
NC[C@H]1C[C@]1(F)c1ccccc1
NC[C@H]1C[C@]1(F)c1cccc(F)c1
CNC[C@H]1C[C@]1(F)c1ccccc1
COc1ccc(F)cc1C1(F)CC1CN
NC[C@H]1C[C@]1(F)c1ccccc1Br
Cc1cccc(c1)[C@@]1(F)C[C@@H]1CN
FC(F)Oc1ccc(NC(=O)NC2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cn1
CN1CCN(CC1)c1nc(N)nc(COc2cccc(C)c2)n1
CC(C)c1ccc(C)cc1OCc1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(COc2ccccc2C)n1
CN1CCN(CC1)c1nc(N)nc(COc2ccc(Cl)c(C)c2)n1
CN1CCN(CC1)c1nc(N)nc(CSc2ccccc2)n1
CC(Sc1ccccc1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CC([Se]c1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(CS(=O)(=O)c2ccccc2Cl)n1
CN1CCN(CC1)c1nc(N)nc(COc2ccccc2)n1
CC(Oc1ccccc1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(C[Se]c2ccccc2)n1
CC(Oc1cccc(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccc(OC)cc23)c1=O
Clc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O |(33.29,-6.1,;31.96,-5.32,;31.97,-3.79,;30.64,-3.01,;29.3,-3.78,;29.3,-5.32,;30.63,-6.09,;30.62,-7.62,;29.29,-8.39,;27.96,-7.61,;26.63,-8.39,;26.63,-9.93,;27.96,-10.69,;29.28,-9.93,;30.61,-10.7,;30.6,-12.24,;31.94,-9.94,;33.27,-10.72,;34.61,-9.96,;35.94,-10.74,;37.28,-9.97,;38.61,-10.75,;39.94,-9.99,;41.27,-10.78,;41.25,-12.32,;39.91,-13.08,;38.59,-12.3,;39.9,-14.62,;38.65,-15.51,;39.11,-16.98,;40.64,-16.99,;41.66,-18.14,;43.17,-17.84,;43.65,-16.37,;42.64,-15.23,;41.14,-15.53,;31.95,-8.4,;33.29,-7.64,)|
Fc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O |(55.11,-5.24,;53.78,-4.47,;53.79,-2.93,;52.45,-2.15,;51.11,-2.93,;51.12,-4.46,;52.44,-5.23,;52.44,-6.77,;51.11,-7.54,;49.78,-6.76,;48.45,-7.54,;48.45,-9.08,;49.78,-9.84,;51.1,-9.08,;52.42,-9.85,;52.42,-11.39,;53.76,-9.09,;55.09,-9.87,;56.43,-9.1,;57.76,-9.88,;59.1,-9.12,;60.43,-9.9,;61.75,-9.14,;63.08,-9.92,;63.07,-11.47,;61.73,-12.22,;60.41,-11.44,;61.72,-13.76,;60.46,-14.65,;60.93,-16.12,;62.46,-16.13,;63.48,-17.29,;64.98,-16.98,;65.47,-15.52,;64.45,-14.37,;62.95,-14.68,;53.77,-7.55,;55.11,-6.79,)|
Clc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O
Fc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccc(F)cc23)c1=O
O=c1c(-c2ccccc2)c2CCCCn2c(=O)n1CCCCN1CCCC(C1)c1c[nH]c2ccccc12
Fc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O
C(N1CCC(=CC1)c1c[nH]c2ccccc12)c1ccccc1 |c:4|
COc1cccc(CN2CCC(=CC2)c2c[nH]c3ccccc23)c1 |c:11|
C(N1CCC(=CC1)c1c[nH]c2ccccc12)c1ccco1 |c:4|
C(N1CCC(=CC1)c1c[nH]c2ccccc12)c1cccs1 |c:4|
COc1ccc2[nH]cc(C3=CCN(Cc4cccs4)CC3)c2c1 |t:9|
COc1ccc2[nH]cc(C3=CCN(Cc4cc(=O)[nH]c5ccccc45)CC3)c2c1 |t:9|
CCOc1ccc2[nH]cc(C3=CCN(Cc4ccccc4)CC3)c2c1 |t:10|
COc1ccc2c(c1)oc1ccc(CN3CCN(CC3)c3ccccc3OC)cc1c2=O
COc1ccc2c(c1)oc1c(CN3CCN(CC3)c3ccccc3OC)cccc1c2=O
OCCOCCN1CCN(Cc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)CC1
[H][C@]12Cc3cccc(OCc4ccc(F)cc4)c3-c3cc(OC)cc(CCN1CCC)c23
[H][C@]12Cc3cccc(OCCCF)c3-c3cc(OC)cc(CCN1CCC)c23
[H][C@]12Cc3cccc(OC(=O)c4ccc(F)cc4)c3-c3cc(OC)cc(CCN1C)c23
[H][C@]12Cc3cccc(OCc4ccc(F)cc4)c3-c3cc(OC)cc(CCN1C)c23
[H][C@]12Cc3cccc(OCCCF)c3-c3cc(OC)cc(CCN1C)c23
[H][C@]12Cc3cccc(OC(=O)c4ccc(F)cc4)c3-c3cc(OC)cc(CCN1CCC)c23
[H][C@]12Cc3cccc(OCCF)c3-c3cc(OC)cc(CCN1CCC)c23
[H][C@]12Cc3cccc(OCCF)c3-c3cc(OC)cc(CCN1C)c23
O=C1N(CCCCCCN2CCN(CC2)c2ccccn2)c2cccc3cccc1c23
O=C1N(CCCCCCN2CCN(CC2)c2ccccn2)C(=O)c2cccc3cccc1c23
COc1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
CCOc1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
CCOc1ccccc1N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
O=S1(=O)N(CCCCCCN2CCN(CC2)c2ccccn2)c2cccc3cccc1c23
[O-][N+](=O)c1ccccc1N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
COc1cccc(c1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)CC1
COc1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)CC1
COc1ccccc1N1CCN(CCCCCCn2c3cccc4CCCn(c34)c2=O)CC1
CCOc1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)CC1
O=C1N(CCCCCCN2CCN(CC2)c2cccc3cccnc23)c2cccc3cccc1c23
[O-][N+](=O)c1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
COc1cccc(c1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
O=C1N(CCCCCCN2CCN(CC2)c2ncccn2)c2cccc3cccc1c23
COc1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)CC1
[O-][N+](=O)c1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)CC1
Clc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
FC(F)(F)c1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Fc1cccc(c1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Brc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1ccccc1N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1cccc(c1)N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1cccc(N2CCN(CCCCCCN3c4cccc5cccc(c45)S3(=O)=O)CC2)c1Cl
Clc1ccc(cc1Cl)N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
FC(F)(F)c1ccc(cc1)N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Clc1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Clc1ccc(cc1Cl)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Brc1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Fc1ccc(cc1)N1CCN(CCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Fc1ccccc1N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1ccc(cc1)N1CCN(CCCCCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Fc1ccccc1N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Clc1cccc(N2CCN(CCCCCCN3C(=O)c4cccc5cccc3c45)CC2)c1Cl
FC(F)(F)c1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Fc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Clc1cccc(c1)N1CCN(CCCCCCN2C(=O)c3cccc4cccc2c34)CC1
Fc1ccccc1N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1
Cc1ncc2nccn2c1-c1ccc(Oc2nccc3occc23)cc1C(F)(F)F |(17.28,-55.18,;17.28,-53.64,;18.61,-52.87,;18.61,-51.33,;17.26,-50.56,;16.94,-49.07,;15.41,-48.91,;14.79,-50.31,;15.93,-51.33,;15.95,-52.87,;14.62,-53.65,;14.63,-55.19,;13.29,-55.96,;11.96,-55.19,;10.63,-55.96,;10.64,-57.5,;11.97,-58.26,;11.98,-59.81,;10.64,-60.59,;9.31,-59.81,;7.83,-60.29,;6.93,-59.04,;7.84,-57.79,;9.31,-58.27,;11.95,-53.66,;13.28,-52.88,;13.27,-51.34,;11.93,-50.58,;14.38,-50.56,;13.26,-49.79,)|
FC(F)(F)c1cc(Oc2nccc3occc23)ccc1-c1cccc2nccn12
Cc1cc(Oc2nccc3occc23)ccc1-c1c(C)ncc2nccn12 |(29.98,-5.28,;29.99,-6.82,;28.67,-7.59,;28.68,-9.13,;27.35,-9.9,;27.36,-11.44,;28.69,-12.2,;28.7,-13.75,;27.36,-14.52,;26.03,-13.75,;24.57,-14.23,;23.66,-13,;24.55,-11.74,;26.02,-12.21,;30.02,-9.9,;31.35,-9.12,;31.34,-7.58,;32.66,-6.8,;34,-7.57,;34.01,-9.11,;35.33,-6.79,;35.32,-5.25,;33.97,-4.49,;33.64,-2.99,;32.12,-2.84,;31.5,-4.24,;32.64,-5.27,)|
FC(F)(F)c1cc(Oc2nccc3ccsc23)ccc1-c1cccc2nccn12
CCOc1ccc2[nH]cc(-c3cncn3CC)c2c1
Cn1cncc1-c1c[nH]c2ccc(Br)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(cc12)C(N)=O
CCn1cncc1-c1c[nH]c2ccc(I)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(OC)cc12
CCn1cncc1-c1c[nH]c2ccccc12
CCn1cncc1-c1c[nH]c2ccc(F)cc12
CCn1cncc1-c1c[nH]c2ccc(Cl)cc12
CCn1cncc1-c1c[nH]c2ccc(I)cc12
CCn1cncc1-c1c[nH]c2ccc(OC(F)(F)F)cc12
CCn1cncc1-c1c[nH]c2cc(F)ccc12
CCn1cncc1-c1c[nH]c2cc(F)c(Cl)cc12
Cn1cncc1-c1c[nH]c2ccc(F)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(F)c(F)c12
Cn1cncc1-c1c[nH]c2ccc(Br)cc12
Cn1cncc1-c1c[nH]c2ccc(I)cc12
COc1ccc2[nH]cc(-c3cncn3C)c2c1F
Cn1cncc1-c1c[nH]c2ccc(C(N)=O)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(C(N)=O)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(Br)cc12
CCn1cncc1-c1c[nH]c2ccc(Cl)c(F)c12
CCn1cncc1-c1c[nH]c2c(F)cc(I)cc12
CCn1cncc1-c1c[nH]c2ccc(C)cc12
CCn1cncc1-c1c[nH]c2ccc(cc12)C(F)(F)F
CCn1cncc1-c1c[nH]c2cccc(F)c12
Cn1cncc1-c1c[nH]c2ccc(Cl)c(F)c12
CCn1cncc1-c1c[nH]c2ccc(OC)c(F)c12
[H][C@]12OC(C)(C)O[C@@]1([H])[C@@]1([H])Cn3cc(COCCCCCCN(CCc4ccc5ccccc5c4)CC[C@@]([H])(O1)[C@@H]2OCCC(C)C)nn3 |r|
[H][C@]12OC(C)(C)O[C@@]1([H])[C@@]1([H])COCc3cn(C[C@@]4([H])O[C@]([H])(CCN(CCc5ccc6ccccc6c5)CC[C@@]([H])(O1)[C@@H]2OCCC(C)C)[C@H](OCCC(C)C)[C@@]1([H])OC(C)(C)O[C@@]41[H])nn3 |r|
COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1
O=c1c(-c2ccccc2)c2ccccn2c(=O)n1CCCCN1CCCC(C1)c1c[nH]c2ccccc12
COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccc(OC)cc23)c1=O
COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O
Fc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccccc23)c1=O
CCCN(CC[C@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1CCc2nc(N)sc2C1 |r,wU:6.5,9.11,wD:24.26,6.6,(12.17,-57.06,;12.17,-55.52,;10.84,-54.75,;10.84,-53.21,;12.18,-52.44,;13.51,-53.21,;14.85,-52.45,;14.83,-53.98,;16.33,-52.85,;16.73,-51.37,;15.24,-50.96,;18.07,-50.6,;19.4,-51.38,;19.39,-52.92,;20.77,-50.64,;20.76,-49.1,;22.08,-48.34,;23.41,-49.1,;24.74,-48.33,;26.07,-49.11,;26.07,-50.65,;24.73,-51.41,;23.4,-50.63,;22.09,-51.39,;9.51,-52.44,;9.51,-50.9,;8.18,-50.12,;6.85,-50.89,;5.38,-50.41,;4.47,-51.66,;2.93,-51.66,;5.38,-52.92,;6.85,-52.44,;8.18,-53.2,)|
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC(F)CCNC(=O)c2cc3ccccc3o2)CC1
CCc1cccc(N2CCN(C[C@H](O)CCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl |r|
CCc1cccc(N2CCN(CC(F)CCNC(=O)c3cc4ccccc4o3)CC2)c1Cl
CCc1cc(Cl)c(OC)c(c1)N1CCN(C[C@H](O)CCNC(=O)c2cc3ccccc3[nH]2)CC1 |r|
CCc1cc(Cl)c(OC)c(c1)N1CCN(C[C@@H](O)CCNC(=O)c2cc3ccccc3[nH]2)CC1 |r|
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC(F)CCNC(=O)c2cc3ccccc3[nH]2)CC1
CCc1cccc(N2CCN(CC(F)CCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl
CCc1cccc(N2CCN(C[C@@H](O)CCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl |r|
[O-][N+](=O)c1cn(cn1)-c1ccc(cc1)C(=O)C1CC1
O=C(C1CC1)c1ccc(cc1)-n1ccnc1
O=C(C1CC1)c1ccc(cc1)N1CCN(Cc2ccccc2)CC1
COc1ccc2n(cc(C3=CCNCC3)c2c1)S(=O)(=O)c1cccc2ncccc12 |t:9|
Clc1ccc2n(cc(C3=CCNCC3)c2c1)S(=O)(=O)c1ccc2cccnc2c1 |t:8|
COc1ccc2n(cc(C3=CCNCC3)c2c1)S(=O)(=O)c1ccc2cccnc2c1 |t:9|
COc1ccc2n(cc(C3=CCNCC3)c2c1)S(=O)(=O)c1cncc2ccccc12 |t:9|
O=S(=O)(c1ccc2ncccc2c1)n1cc(C2=CCNCC2)c2ccccc12 |t:18|
CCCCN1CCN(CC1)c1cccc(CC)c1Cl
CCCCN1CCN(CC1)c1cc(CC)cc(Cl)c1OC
CCc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1Cl
CCc1cc(Cl)c(OC)c(c1)N1CCNCC1
CCc1cc(Cl)c(OC)c(c1)N1CCN(C)CC1
CCc1cccc(N2CCN(C)CC2)c1Cl
CCc1cc(Cl)c(OC)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3o2)CC1
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC(O)CCNC(=O)c2cc3ccccc3o2)CC1
CCc1cccc(N2CCN(CC(O)CCNC(=O)c3cc4ccccc4o3)CC2)c1Cl
CCc1cccc(N2CCNCC2)c1Cl
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC(O)CCNC(=O)c2cc3ccccc3[nH]2)CC1
CCc1cccc(N2CCN(CC(O)CCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl
CCc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl
CCc1cc(Cl)c(OC)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3[nH]2)CC1
CCCn1c2ccccc2n(CCCCN2CCN(CC2)c2ccc(F)cc2)c1=O
CCCCCn1c2ccccc2n(CCCCN2CCN(CC2)c2ccc(F)cc2)c1=O
CNCCc1c[nH]c2cccc(O)c12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccccc2F)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccc(F)cc2)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccccc2Cl)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2cccc(Cl)c2)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2cccc(c2)C(F)(F)F)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccccc2OCC)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccc(C)cc2C)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2c(C)cccc2C)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2c(F)cccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2c(F)cccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2cc(F)ccc12
CCOC(=O)Cc1nn(CNC(=O)CCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2cc(F)ccc12
Cc1ccc(cc1C)N1CCN(CCC(=O)NCc2nc3ccccc3c(=O)n2-c2ccccc2)CC1
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2ccccc12
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2c(F)cccc12
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2c(F)cccc12
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2ccc(C)c(C)c2)c(=O)c2cc(F)ccc12
CCOC(=O)Cc1nn(CNC(=O)CCCN2CCN(CC2)c2cccc(C)c2C)c(=O)c2cc(F)ccc12
Cc1cccc(N2CCN(CCCC(=O)NCn3nc(CC(N)=O)c4ccccc4c3=O)CC2)c1C
Cc1cccc(N2CCN(CCCC(=O)NCn3nc(CC(N)=O)c4cccc(F)c4c3=O)CC2)c1C
Cc1cccc(N2CCN(CCCC(=O)NCn3nc(CC(N)=O)c4ccc(F)cc4c3=O)CC2)c1C
Cc1nccc2-c3ccc(Br)cc3NC(C)(C)c12
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCNCC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC2)S(C)(=O)=O)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC2)C(=S)NC(C)C)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC2)C(=O)CCC(O)=O)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC2)C(=O)CC[C@H](N)C(O)=O)cc1 |r|
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC2)C(=O)C[C@H](N)C(O)=O)cc1 |r|
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCC(O)CN2CCN(CC2)C(=O)OC(C)(C)C)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCC(O)CN2CCN(CC2)c2nsc3ccccc23)cc1
CN1CCC(CC1)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(OCC(O)CN2CCC(CC2)c2noc3cc(F)ccc23)cc1
[H][C@@]12CCC[C@]1([H])C1=CC=CC3CNCCN(C2)C13 |r,c:10,t:8|
C1Cc2cccc3CNCCN1c23
Clc1ccc2CNCCN3CCc1c23
C1CN2CCNCc3cccc(C1)c23
Clc1ccc2CNCCN3CCCc1c23
Clc1ccc2CNCCN3CCOc1c23
Clc1ccc2CNCCN3CCSc1c23
[O-][S+]1CCN2CCNCc3ccc(Cl)c1c23
Clc1ccc2CNCCN3CCS(=O)(=O)c1c23
C1CCc2cccc3CNCCN(C1)c23
Brc1ccc2CNCCN3CCCCc1c23
Clc1cc2CCN3CCNCc(c1)c23
Fc1ccc2CNCCN3CCc1c23
Brc1ccc2CNCCN3CCc1c23
FC(F)(F)c1ccc2CNCCN3CCc1c23
COc1ccc2CNCCN3CCc1c23
Cc1ccc2CNCCN3CCc1c23
CCc1ccc2CNCCN3CCc1c23
CCCc1ccc2CNCCN3CCc1c23
CC(C)Cc1ccc2CNCCN3CCc1c23
C1CC1c1ccc2CNCCN3CCc1c23
C(c1ccccc1)c1ccc2CNCCN3CCc1c23
CC1CN2CCNCc3cccc1c23
CC1Cc2cccc3CNCCN1c23
C[C@@H]1[C@H](C)c2cccc3CNCCN1c23 |r|
C[C@H]1[C@H](C)c2cccc3CNCCN1c23 |r|
FC(F)(F)CC1CN2CCNCc3cccc1c23
CC1(C)CN2CCNCc3cccc1c23
CCC1(CC)CN2CCNCc3cccc1c23
C1CC2(C1)CN1CCNCc3cccc2c13
C1N2CCNCc3cccc(c23)C11CCOCC1
CC1CN2CCNCc3ccc(C)c1c23
CC1CN2CCNCc3ccc(Cl)c1c23
CC1CN2CCNCc3ccc(Br)c1c23
FC(F)(F)CC1CN2CCNCc3ccc(Br)c1c23
CC1CN2CCNCc3cc(Cl)cc1c23
CC1CN2CCNCc3cc(Cl)c(Cl)c1c23
CC1CN2CCNCc3cc(C)c(Cl)c1c23
CC1NCCN2CC(C)(C)c3cccc1c23
CC1CN2CC(C)(C)c3cccc(CN1)c23
CC1CNCc2cccc3c2N1CC3(C)C
CC1(C)CN2CCNCc3ccc(Br)c1c23
CC1(C)CN2CCNCc3ccc(Cl)c1c23
CC1(C)CN2CCNCc3ccc(F)c1c23
Cc1ccc2CNCCN3CC(C)(C)c1c23
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)nc2ccccn12
Fc1ccc2nn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)n2c1
Fc1cccn2c1nn(CCCCN1CCN(CC1)c1cccc3sccc13)c2=O
Fc1cc(F)c2nn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)n2c1
Clc1ccc2nn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)n2c1
Clc1cccn2c1nn(CCCCN1CCN(CC1)c1cccc3sccc13)c2=O
Clc1cc(Cl)c2nn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)n2c1
Brc1cccn2c1nn(CCCCN1CCN(CC1)c1cccc3sccc13)c2=O
COc1cccc2nn(CCCCN3CCN(CC3)c3cccc4sccc34)c(=O)n12
COc1cccn2c1nn(CCCCN1CCN(CC1)c1cccc3sccc13)c2=O
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)nc2cccc(C#N)n12
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)nc2ccc(cn12)C#N
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)nc2cc(ccn12)C#N
O=c1n(CCCCN2CCN(CC2)c2cccc3sccc23)nc2c(cccn12)C#N
O=c1n(CCCCN2CCN(CC2)c2cccc3scnc23)nc2ccccn12
Fc1cc(C2CCN(CCCCn3nc4ccccn4c3=O)CC2)c2cnoc2c1
Fc1cccn2c1nn(CCCCN1CCN(CC1)c1cccc3scnc13)c2=O
Fc1cc2c(cccc2s1)N1CCN(CCCCn2nc3c(F)cccn3c2=O)CC1
CSC(=NCC[N+]1(C)CCN(CC1)c1ncccn1)C12CC3CC(CC(C3)C1)C2
S=C(NCCN1CCN(CC1)c1ncccn1)C12CC3CC(CC(C3)C1)C2 |TLB:1:17:20:24.22.23,THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
C(C[N+]1(Cc2ccccc2)CCN(CC1)c1ncccn1)N=C(SCc1ccccc1)C12CC3CC(CC(C3)C1)C2
O=C(NCCN1CCN(CC1)c1ncccn1)C12CC3CC(CC(C3)C1)C2
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1OCC1CC1)c23
CCCC(=O)Nc1ccc2CC3N(C)CCc4cc(OC)c(OC)c(-c2c1)c34
COc1cc2CCN(C)C3Cc4ccc(NC(C)=O)cc4-c(c1OCC1CC1)c23
CCCC(=O)Nc1ccc2CC3N(C)CCc4cc(OC)c(OCC5CC5)c(-c2c1)c34
CCCC(=O)Nc1ccc2CC3N(C)CCc4cc(OC)c(OCC=C)c(-c2c1)c34
CCCC(=O)Nc1ccc2CC3N(C)CCc4cc(OC)c(OCC#C)c(-c2c1)c34
COc1cc2CCN(C)C3Cc4ccc(NS(C)(=O)=O)cc4-c(c1OCC1CC1)c23
COc1cc2CCN(C)C3Cc4ccc(NS(C)(=O)=O)cc4-c(c1OCC=C)c23
COc1cc2CCN(C)C3Cc4ccc(NS(C)(=O)=O)cc4-c(c1OCC#C)c23
COc1cc2CCN(C)C3Cc4ccc(NC(N)=O)cc4-c(c1OCC1CC1)c23
COc1cc2CCN(C)C3Cc4ccc(cc4-c(c1OC)c23)N(C)C
COc1cc2CCN(C)C3Cc4ccc(cc4-c(c1OCC1CC1)c23)N(C)C
COc1cc2CCN(C)C3Cc4ccc(cc4-c(c1OCC=C)c23)N(C)C
CN(C)c1ccc2CC3N(C)CCc4cccc(-c2c1)c34
CN1CCc2cccc-3c2C1Cc1ccc2nc(N)sc2c-31
COc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
COCCOc1cccc(C(=O)C2CCN(CCc3ccc(F)cc3)CC2)c1OC
COc1ccccc1C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COc1cccc(c1)C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COc1ccc(cc1)C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COCCOc1ccccc1C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COCCOc1cccc(c1)C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COCCOc1ccc(cc1)C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
Oc1ccc(cc1)C1CCN(CC1)c1ccn2c(CC3CC3)nnc2c1Cl
COc1c(OCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(cc2)C2CCN(CC2)c2ccn3c(CC4CC4)nnc3c2Cl)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1cc2CCN(C)C3Cc4ccc(NC(C)=O)cc4-c(c1OCC#C)c23
COc1cc2CCN(C)C3Cc4ccc(NC(C)=O)cc4-c(c1OCC=C)c23
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1OCC#C)c23
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1OCC=C)c23
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1OC1CC1)c23
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1OC)c23
COc1cc2CCN(C)C3Cc4ccc(N)cc4-c(c1O)c23
COc1cc2CCN(C)C3Cc4ccc(cc4-c(c1OC)c23)[N+]([O-])=O
COc1cc2CCN(C)C3Cc4ccc(cc4-c(c1O)c23)[N+]([O-])=O
CN1CCc2cccc3-c4cc(NC(C)=O)ccc4CC1c23
CN1CCc2cccc3-c4cc(N)ccc4CC1c23
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3nsc4ccccc34)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3ccccc3Cl)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3cccc(Cl)c3)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3ccc(Cl)cc3)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)C(=O)[C@]21[H] |r|
[H][C@]12CC[C@]([H])(C1)[C@]1([H])C(=O)N(CCCCCCN3CCN(CC3)c3ccccc3OC)C(=O)[C@]21[H] |r|
O=C1N(CCCCCCN2CCN(CC2)c2nsc3ccccc23)C(=O)c2ccccc12
O=c1n(CCCCCCN2CCN(CC2)c2nsc3ccccc23)nc2ccccn12
O=c1oc2ccccc2n1CCCCCCN1CCN(CC1)c1nsc2ccccc12
C(CCCN1CCN(CC1)c1nsc2ccccc12)CCSc1nc2ccccc2o1
O=C1CCc2cc(OCCCCCCN3CCN(CC3)c3nsc4ccccc34)ccc2N1
O=C1N(CCCCCCN2CCN(CC2)c2nsc3ccccc23)c2cccc3cccc1c23
O=S1(=O)N(CCCCCCN2CCN(CC2)c2nsc3ccccc23)c2cccc3cccc1c23
O=C1N(CCCCCCN2CCN(CC2)c2nsc3ccccc23)C(=O)c2cccc3cccc1c23
O=c1n(CCCCCCN2CCN(CC2)c2nsc3ccccc23)c2cccc3CCCn1c23
FC(F)(F)c1cccc(c1)N(CCCCCCN1CCN(CC1)c1nsc2ccccc12)S(=O)(=O)c1ccccc1
Cc1ccc(cc1)S(=O)(=O)N(CCCCCCN1CCN(CC1)c1nsc2ccccc12)c1ccccc1
O=c1[nH]c2ccccc2n1CCCCCCN1CCN(CC1)c1nsc2ccccc12
O=C(NCCCCCCN1CCN(CC1)c1nsc2ccccc12)c1ccccc1
O=S(=O)(NCCCCCCN1CCN(CC1)c1nsc2ccccc12)c1ccccc1
O=S(=O)(NCCCCCCN1CCN(CC1)c1nsc2ccccc12)c1cccc2ccccc12
O=S(=O)(NCCCCCCN1CCN(CC1)c1nsc2ccccc12)c1ccc2ccccc2c1
CN(C)CCN1c2ccccc2N(C)c2ccccc2C1=O
CN(C)CCN1c2ccccc2\C=C/c2ccccc2C1=O |c:13|
CN(C)CCCN1c2ccccc2\C=C/c2ccccc2C1=O |c:14|
CN(C)CCN1c2ccccc2C(=O)N(C)c2ccccc2C1=O
O=C1N(CCCN2CCOCC2)c2ccccc2\C=C/c2ccccc12 |c:20|
CN1CCN(CCCN2c3ccccc3\C=C/c3ccccc3C2=O)CC1 |c:16|
C[C@H]1C=C(CCN1C)C1=Nc2cc(Cl)ccc2Nc2ccc(C)cc12 |r,c:2,t:9|
CCc1ccc2Nc3ccc(Cl)cc3N=C(C3=C[C@H](C)N(C)CC3)c2c1 |r,t:15,17|
CCOc1ccc2Nc3ccc(Cl)cc3N=C(C3=C[C@H](C)N(C)CC3)c2c1 |r,t:16,18|
C[C@H]1C=C(CCN1C)C1=Nc2cc(Cl)ccc2Nc2ccc(OC(F)(F)F)cc12 |r,c:2,t:9|
CN(C)CC\C=C\c1cccnc1
CC(C)n1nc2CCNCCc2c1-c1ccc(F)cc1
CNc1ccc(cc1)-c1c2CCNCCc2nn1C(C)C
Fc1ccc(cc1)-c1c2CCNCCc2nn1C1CCC1
Fc1ccc(cc1)-c1c2CCNCCc2nn1C1CC1
CC(C)n1nc2CCNCCc2c1-c1ccc(Cl)cc1Cl |(31.47,-50.99,;30.01,-50.52,;29.69,-49.01,;28.87,-51.55,;27.36,-51.23,;26.59,-52.57,;25.04,-52.68,;24.17,-53.95,;24.62,-55.43,;26.05,-56,;27.38,-55.23,;27.62,-53.71,;29.03,-53.08,;30.36,-53.85,;31.69,-53.08,;33.02,-53.84,;33.03,-55.39,;34.36,-56.16,;31.69,-56.16,;30.36,-55.39,;29.02,-56.16,)|
CC(C)n1nc2CCNCCc2c1-c1ccc(Cl)c(Cl)c1
CC(C)n1nc2CCNCCc2c1-c1ccc(OC(F)(F)F)cc1
CC(C)n1nc2CCNCCc2c1-c1ccc(cc1)C(F)(F)F
CC(C)n1nc2CCNCCc2c1-c1ccc(cc1)C#N
CC(C)n1nc2CCNCCc2c1-c1ccc(Cl)cc1
COc1ccc(cc1)-c1c2CCNCCc2nn1C(C)C
CC(C)n1nc2CCNCCc2c1-c1ccc(C)cc1
C1Cc2nn(c(c2CCN1)-c1ccccc1)-c1ccccc1
C1CC(C1)n1nc2CCNCCc2c1-c1ccccc1
C1CC1n1nc2CCNCCc2c1-c1ccccc1
CC(C)(C)n1nc2CCNCCc2c1-c1ccccc1
CC(C)n1nc2CCNCCc2c1-c1ccccc1
CCn1nc2CCNCCc2c1-c1ccccc1
Clc1ccc(cc1)-c1nn(Cc2ccccc2)c2CCNCCc12
C[C@H]1CN(CC[C@H]2CC[C@@H](CC2)NC(=O)N(C)C)CCc2ccc(Cl)cc12 |r,wU:9.12,wD:6.5,1.0,(18.24,-31.84,;17.89,-33.34,;16.38,-33.68,;15.71,-35.08,;14.17,-35.08,;13.4,-36.42,;11.86,-36.42,;11.09,-35.08,;9.55,-35.08,;8.78,-36.42,;9.55,-37.75,;11.09,-37.75,;7.24,-36.42,;6.47,-37.75,;7.24,-39.08,;4.93,-37.75,;4.16,-36.42,;4.16,-39.08,;16.38,-36.48,;17.89,-36.82,;19.1,-35.85,;20.44,-36.62,;21.78,-35.85,;21.77,-34.3,;23.1,-33.52,;20.44,-33.54,;19.11,-34.31,)|
C[C@H]1CN(CC[C@H]2CC[C@@H](CC2)N2C(=O)CC3(CCCC3)CC2=O)CCc2ccc(Cl)cc12 |r,wU:9.12,wD:6.5,1.0,(78.22,-16.9,;77.88,-18.4,;76.36,-18.74,;75.69,-20.14,;74.15,-20.14,;73.38,-21.48,;71.84,-21.48,;71.07,-20.14,;69.53,-20.14,;68.76,-21.48,;69.53,-22.81,;71.07,-22.81,;67.22,-21.48,;66.46,-22.81,;67.23,-24.15,;64.91,-22.81,;64.15,-21.47,;63.25,-20.22,;61.79,-20.69,;61.78,-22.23,;63.24,-22.71,;64.92,-20.14,;66.46,-20.14,;67.23,-18.81,;76.36,-21.54,;77.87,-21.88,;79.09,-20.91,;80.42,-21.68,;81.76,-20.91,;81.75,-19.36,;83.08,-18.58,;80.42,-18.6,;79.09,-19.37,)|
C[C@H]1CN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccco2)CCc2ccc(Cl)cc12 |r,wU:9.12,wD:6.5,1.0,(19.71,-32.34,;19.37,-33.84,;17.85,-34.19,;17.18,-35.59,;15.64,-35.59,;14.87,-36.92,;13.33,-36.92,;12.56,-35.59,;11.02,-35.59,;10.25,-36.92,;11.02,-38.26,;12.56,-38.26,;8.71,-36.92,;7.94,-38.26,;8.71,-39.59,;6.4,-38.26,;5.49,-37.02,;4.03,-37.49,;4.03,-39.03,;5.49,-39.51,;17.85,-36.99,;19.36,-37.33,;20.57,-36.36,;21.91,-37.13,;23.25,-36.36,;23.24,-34.81,;24.57,-34.03,;21.91,-34.04,;20.58,-34.81,)|
COc1ccc2OCCc2c1[C@@H]1C[C@H]1CN
CCOc1ccc2OCCc2c1[C@@H]1C[C@H]1CN
NC[C@@H]1C[C@H]1c1c2CCOc2ccc1OCCF
COc1ccc2occc2c1[C@@H]1C[C@H]1CN
CCOc1ccc2occc2c1[C@@H]1C[C@H]1CN
NC[C@@H]1C[C@H]1c1c(OCCF)ccc2occc12
CC(C)Oc1ccc2occc2c1[C@@H]1C[C@H]1CN
COc1ccc2OCCc2c1[C@H]1C[C@@H]1CN
CCOc1ccc2OCCc2c1[C@H]1C[C@@H]1CN
CCCOc1ccc2OCCc2c1[C@H]1C[C@@H]1CN
NC[C@H]1C[C@@H]1c1c2CCOc2ccc1OCC=C
NC[C@H]1C[C@@H]1c1c2CCOc2ccc1OCC1CC1
NC[C@H]1C[C@@H]1c1c2CCOc2ccc1OCCF
COc1ccc2occc2c1[C@H]1C[C@@H]1CN
CCOc1ccc2occc2c1[C@H]1C[C@@H]1CN
CCCOc1ccc2occc2c1[C@H]1C[C@@H]1CN
NC[C@H]1C[C@@H]1c1c(OCC=C)ccc2occc12
NC[C@H]1C[C@@H]1c1c(OCCF)ccc2occc12
NC[C@H]1C[C@@H]1c1c(OCC2CC2)ccc2occc12
CC(C)Oc1ccc2occc2c1[C@H]1C[C@@H]1CN
NC[C@H]1C[C@@H]1c1c(OCC(F)=C)ccc2occc12
CC(=C)COc1ccc2occc2c1[C@H]1C[C@@H]1CN
CCc1cc2c([C@H]3C[C@@H]3CN)c(OC)ccc2o1
CCOc1ccc2oc(CC)cc2c1[C@H]1C[C@@H]1CN
CCc1cc2c([C@H]3C[C@@H]3CN)c(OCCF)ccc2o1
Fc1ccc2cc(sc2c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Fc1ccc2cc(sc2c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1ccc2cc(sc2c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1ccc2cc(sc2c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
O=S(=O)(N[C@H]1CCN(CCCc2noc3ccccc23)C1)c1cc2ccccc2s1 |r|
O=S(=O)(N[C@@H]1CCN(CCCc2noc3ccccc23)C1)c1cc2ccccc2s1 |r|
O=S(=O)(N[C@H]1CCN(CCCc2noc3ccccc23)C1)c1csc2ccccc12 |r|
O=S(=O)(N[C@@H]1CCN(CCCc2noc3ccccc23)C1)c1csc2ccccc12 |r|
O=S(=O)(N[C@H]1CCN(CCCc2noc3ccccc23)C1)c1cc2ccccc2o1 |r|
O=S(=O)(N[C@@H]1CCN(CCCc2noc3ccccc23)C1)c1cc2ccccc2o1 |r|
Cn1ccc2cc(ccc12)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cn1ccc2cc(ccc12)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cn1ccc2c(cccc12)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cn1ccc2c(cccc12)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1ccc2cc(ccc2c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1ccc2cc(ccc2c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
COc1ccc2cc(ccc2c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
COc1ccc2cc(ccc2c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
O=S(=O)(N[C@H]1CCN(CCCc2noc3ccccc23)C1)c1ccc2ccccc2c1 |r|
O=S(=O)(N[C@@H]1CCN(CCCc2noc3ccccc23)C1)c1ccc2ccccc2c1 |r|
O=S(=O)(N[C@H]1CCN(CCCc2noc3ccccc23)C1)c1cccc2ccccc12 |r|
Fc1ccc(cc1Cl)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
O=S(=O)(N[C@@H]1CCN(CCCc2noc3ccccc23)C1)c1cccc2ccccc12 |r|
Cc1c(sc2ccc(F)cc12)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1c(sc2ccc(F)cc12)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1ccc2sc(cc2c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1ccc2sc(cc2c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1cccc(c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Cc1cccc(c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Fc1ccc(cc1Cl)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Fc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1cccc(c1)S(=O)(=O)N[C@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Fc1ccc(cc1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Clc1cccc(c1)S(=O)(=O)N[C@@H]1CCN(CCCc2noc3ccccc23)C1 |r|
Fc1ccc2[nH]cc(CCCN3CCN(CC(=O)N(C4CCCCC4)c4ccccc4)CC3)c2c1
CCCN(CCCN1CCN(CC1)c1cccc(Cl)c1Cl)C(=O)c1ccccc1
CC(C)N(CCCN1CCN(CC1)c1cccc(Cl)c1Cl)C(=O)c1ccccc1
Clc1cccc(N2CCN(CCCN(CC3CC3)C(=O)c3ccccc3)CC2)c1Cl
Clc1cccc(N2CCN(CCCN(C3COC3)C(=O)c3ccccc3)CC2)c1Cl
CCCN(CCCN1CCN(CC1)c1ccccn1)C(=O)c1ccccc1
O=C(N(CCCN1CCN(CC1)c1ccccn1)CC1CC1)c1ccccc1
CCCN(CCCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1ccccc1
CC(C)N(CCCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)c1ccccc1
Fc1ccc2c(noc2c1)C1CCN(CCCN(CC2CC2)C(=O)c2ccccc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCN(C2COC2)C(=O)c2ccccc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCN(C2COC2)S(=O)(=O)c2ccccc2)CC1
Fc1ccc(cc1)S(=O)(=O)N(CCCN1CCC(CC1)c1noc2cc(F)ccc12)C1COC1
Fc1ccc2c(noc2c1)C1CCN(CCCN(C2COC2)S(=O)(=O)c2ccc(Cl)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCN(C2COC2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCN(C2COC2)S(=O)(=O)c2ccc(cc2)C#N)CC1
CCCCCc1cc(c(c(c1)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C)O
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cn2)cc1
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cn1
Cc1ccc(nc1)N1CCN(CCCCc2ccc(F)cc2)CC1
Fc1ccc(CCCCN2CCN(CC2)c2ccc(cn2)-c2ccccc2)cc1
Fc1ccc(CCCCN2CCN(CC2)c2cccc(n2)-c2ccccc2)cc1
Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccccn1
Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccc(Cl)cn1
Fc1ccc2C(=O)C(CCN3CCCN(CC3)c3ccccn3)Cc2c1
Fc1ccc2CC(CCN3CCCN(CC3)c3ccccn3)Cc2c1
Fc1ccc2C(=O)C(CCN3CCCN(CC3)c3ccc(Cl)cn3)Cc2c1
Fc1ccc(CCCCN2C3CCC2CN(C3)c2ccc(Cl)cn2)cc1 |TLB:8:9:15.16.14:11.12,THB:17:15:9:11.12|
Fc1ccc(cc1)C(=O)CCCN1C2CCC1CN(C2)c1ccc(Cl)cn1 |TLB:11:12:18.19.17:14.15,THB:20:18:12:14.15|
Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1cccnc1
Fc1ccc(CCCCN2CCN(CC2)c2cccnc2)cc1
O=C1COc2ccccc2N1CCCCN1CCN(CC1)c1cccc2sccc12
Fc1ccc2c(c1)N(CCCCN1CCN(CC1)c1cccc3sccc13)C(=O)CNC2=O
COc1ccc2ncc(=O)n(CCCCN3CCN(CC3)c3cccc4sccc34)c2c1
CN1CC(=O)N(CCCCN2CCN(CC2)c2cccc3sccc23)c2ccccc2C1=O
O=c1[nH]c(=O)c2ccccc2n1CCCCN1CCN(CC1)c1cccc2sccc12
Oc1ccc2CCS(=O)(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)c2c1
Nc1ccc2CCS(=O)(=O)N(CCCCN3CCN(CC3)c3cccc4sccc34)c2c1
CN1CCc2ccc(OCCCCN3CCN(CC3)c3cccc(Cl)c3Cl)cc2C1=O
CC1CCc2ccc(OCCCCN3CCC(CC3)c3nsc4ccccc34)cc2C1=O
CN1CCc2ccc(OCCCN3CCC(CC3)C(=O)c3ccc(F)cc3F)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3cccc(c3)C(F)(F)F)cc2C1=O
CN1CCc2ccc(OCCCN3CCC(CC3)c3nsc4ccccc34)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(Cc4ccc5OCOc5c4)CC3)cc2C1=O
CN1CCc2ccc(OCCCN3CCN(CC3)c3cccc(Cl)c3Cl)cc2C1=O
CN1CCc2ccc(OCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
CN1CCc2ccc(OCC(F)CN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
Cn1ccc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2c1=O
CN1CCc2cc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc2C1=O
CN(CC#C)Cc1ccc(OCCCCCN2CCN(CC2)c2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1
C[C@H]([C@@H](O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 |r|
C[C@H]([C@H](O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1 |r|
C[C@@H]([C@@H](O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1
[H][C@]12CCc3c(CCC)cccc3N1CCNC2 |r|
[H][C@]12CCc3c(CCC(F)(F)F)cccc3N1CCNC2 |r|
[H][C@]12CCc3c(Cl)ccnc3N1CCNC2 |r|
[H][C@]12CCc3c(ccnc3N1CCNC2)C1CC1 |r|
[H][C@]12CCc3cnccc3N1CCNC2 |r|
[H][C@]12CCc3c(CC4CCC4)nccc3N1CCNC2 |r|
COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CCNS(=O)(=O)c2ccc(N)c(Br)c2)CC1
O=C(NC1CC2CCC(C1)N2Cc1ccncc1)c1ccc2ccccc2c1 |TLB:11:10:3.4.9:6.7|
O=C(NC1CC2CCC(C1)N2Cc1cccnc1)c1ccc2ccccc2c1 |TLB:11:10:3.4.9:6.7|
O=C(NC1CC2CCC(C1)N2Cc1ccccn1)c1ccc2ccccc2c1 |TLB:11:10:3.4.9:6.7|
FC(F)(F)c1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:8:9:15.16.14:11.12|
FC(F)(F)c1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:9:10:16.17.15:12.13|
FC(F)(F)c1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:10:11:17.18.16:13.14|
Fc1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:5:6:12.13.11:8.9|
Fc1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:6:7:13.14.12:9.10|
Fc1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:7:8:14.15.13:10.11|
Brc1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:5:6:12.13.11:8.9|
Brc1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:6:7:13.14.12:9.10|
Brc1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:7:8:14.15.13:10.11|
Clc1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:5:6:12.13.11:8.9|
Clc1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:6:7:13.14.12:9.10|
Clc1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:7:8:14.15.13:10.11|
COc1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:6:7:13.14.12:9.10|
COc1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:7:8:14.15.13:10.11|
COc1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:8:9:15.16.14:11.12|
Cc1ccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)cc1 |TLB:5:6:12.13.11:8.9|
Cc1cccc(CN2C3CCC2CC(C3)NC(=O)c2ccc3ccccc3c2)c1 |TLB:6:7:13.14.12:9.10|
Cc1ccccc1CN1C2CCC1CC(C2)NC(=O)c1ccc2ccccc2c1 |TLB:7:8:14.15.13:10.11|
COc1cc(nc2ccccc12)C(=O)NC1CC2CCC(C1)N2Cc1ccccc1 |TLB:23:22:15.16.21:18.19|
O=C(NC1CC2CCC(C1)N2Cc1ccccc1)c1ccc2ccccc2n1 |TLB:11:10:3.4.9:6.7|
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2cccc(Cl)c2Cl)cc1
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2cccc(c2)C(F)(F)F)cc1
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
COc1ccccc1N1CCN(CCCOc2ccc(NC(C)=O)cc2)CC1
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
CC(=O)Nc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2nsc3ccccc23)cc1
CC(=O)Nc1ccc(OCCCN2CCN(CC2)c2cccc3ccsc23)cc1
CCC(=O)Nc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(NC(=O)c3ccccc3)cc2)CC1
CC(=O)Nc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1F
CC(=O)Nc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1C
CC(=O)NCc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CN(C(C)=O)c1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CC(=O)Nc1ccc(OCCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CC(=O)Nc1ccc(OCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CC(=O)Nc1cccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)c1
CC(=O)Nc1ccc(OCC(O)CN2CCC(CC2)c2noc3cc(F)ccc23)cc1
CN1CCN(CC1)c1cccc2n(ccc12)S(=O)(=O)c1ccccc1
CN1CCCCC1CCN1c2ccc(Br)cc2Sc2cc(Br)ccc12
CN1CCCCC1CCN1c2c(Cl)cc(Cl)cc2Sc2cc(Cl)cc(Cl)c12
CN1CCCCC1CCN1c2ccc(Br)cc2[Se]c2cc(Br)ccc12
CC(=O)Nc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
CC(=O)Nc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Nc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Nc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2NC(=O)CCc2c1
O=C1CCc2cc(CCCCN3CCN(CC3)c3ccccn3)ccc2N1
O=C1CCc2cc(OCCCN3CCN(CC3)c3ccccn3)ccc2N1
O=C1CCc2cc(OCCCN3CCCN(CC3)c3ccccn3)ccc2N1
O=C1CCc2cc(OCCCN3CCN(CC3)c3ccccn3)ccc12
O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2CCCc2c1
Fc1ccc2C(=O)C(CCN3CCN(CC3)c3ccccn3)Cc2c1
OC1C(CCN2CCN(CC2)c2ccccn2)Cc2cc(F)ccc12
Clc1ccc2C(=O)C(CCN3CCN(CC3)c3ccccn3)Cc2c1
Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)Cc2c1
Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)C(=O)c2c1
Clc1cc2CC(CCN3CCN(CC3)c3ccccn3)C(=O)c2cc1Cl
Clc1ccc2C(=O)C(CCCN3CCN(CC3)c3ccccn3)Cc2c1
Clc1ccc2C(=O)C(CCCCN3CCN(CC3)c3ccccn3)Cc2c1
CC1(CCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
CC1(CCCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
Cc1cc(=O)oc2c(Cl)c(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCC3)cc2Cl)CC1
Cc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1CN1CCCC1
COc1cc(CN2CCCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CCN3CCCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)cc2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)c(F)c2)CC1
COc1cc(CN2CCCCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc(CN3CCOCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)c(F)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)c(Cl)c2)CC1
Cc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1CN1CCOCC1
COc1cc(CN2CCOCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
CC1CCN(CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CC1CCN(CCc2ccc(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(Cc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(Cc2ccc(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CCN3CCOCC3)cc2)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1ccc(cc1)N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
COc1ccccc1N1CCN(CCCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1cccc(N2CCN(CCCCN3C(=O)c4ccccc4S3(=O)=O)CC2)c1Cl
O=C1N(CCCCCN2CCN(CC2)c2ccccc2)S(=O)(=O)c2ccccc12
COc1ccccc1N1CCN(CCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
Clc1cccc(N2CCN(CCCCCN3C(=O)c4ccccc4S3(=O)=O)CC2)c1Cl
Clc1ccc(cc1)N1CCN(CCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCCN2C(=O)c3ccccc3S2(=O)=O)CC1
O=C1N(CCCCCN2CCN(CC2)c2ncccn2)S(=O)(=O)c2ccccc12
O=C1N(CCCCCN2CCN(CC2)c2ccccn2)S(=O)(=O)c2ccccc12
O=C1N(CCCCCN2CCN(CC2)c2cccc3ccccc23)S(=O)(=O)c2ccccc12
COc1ccccc1N1CCN(Cc2ccc(CN3C(=O)c4ccccc4S3(=O)=O)cc2)CC1
Cc1cccc(c1)-c1n[nH]cc1N1CCCNCC1
Cc1ccc(cc1)-c1n[nH]cc1N1CCCNCC1
Clc1cccc(c1)-c1n[nH]cc1N1CCCNCC1
Clc1ccc(cc1)-c1n[nH]cc1N1CCCNCC1
Fc1cccc(c1)-c1n[nH]cc1N1CCCNCC1
Fc1ccc(cc1)-c1n[nH]cc1N1CCCNCC1
COc1ccccc1-c1n[nH]cc1N1CCCNCC1
COc1cccc(c1)-c1n[nH]cc1N1CCCNCC1
COc1ccc(cc1)-c1n[nH]cc1N1CCCNCC1
C1CNCCN(C1)c1c[nH]nc1-c1ccccc1
COc1ccccc1-c1n[nH]cc1N1CCNCC1
COc1cccc(c1)-c1n[nH]cc1N1CCNCC1
COc1ccc(cc1)-c1n[nH]cc1N1CCNCC1
C1CN(CCN1)c1c[nH]nc1-c1ccccc1
Clc1ccccc1-c1n[nH]cc1N1CCNCC1
Clc1cccc(c1)-c1n[nH]cc1N1CCNCC1
Clc1ccc(cc1)-c1n[nH]cc1N1CCNCC1
Fc1ccccc1-c1n[nH]cc1N1CCNCC1
Fc1cccc(c1)-c1n[nH]cc1N1CCNCC1
Fc1ccc(cc1)-c1n[nH]cc1N1CCNCC1
Cc1ccc(cc1)-c1n[nH]cc1N1CCNCC1
[2H]C([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])c1c[nH]c2cccc(OC(=O)CCCCCCCC\C=C/C\C=C/CCCCC)c12
[2H]C([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])c1c[nH]c2cccc(OCc3ccccc3)c12
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\F)-c1cccc(-[#7]-[#6](=O)-c2c(F)cc(F)cc2F)n1
O=c1n(ccc2ncccc12)-c1ccc(cc1)N1CCN(CCCc2c[nH]c3ccc(cc23)C#N)CC1
O=c1n(ccc2ncccc12)-c1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1
O=c1n(ccc2occc12)-c1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1
COc1ccc(F)cc1[C@H]1C[C@@H]1CNCCCCOc1ccc2ccc(=O)[nH]c2c1 |r|
COc1ccc(F)cc1[C@H]1C[C@@H]1CNCCCOc1ccc2ccc(=O)[nH]c2c1 |r|
COc1ccc(Cl)cc1[C@H]1C[C@@H]1CNCCCCOc1ccc2CCC(=O)Nc2c1 |r|
COc1ccc(Cl)cc1[C@H]1C[C@@H]1CNCCCOc1ccc2ccc(=O)[nH]c2c1 |r|
CCCN(CC)CCc1c[nH]c2ccccc12
CCCN(CC)CCc1c[nH]c2ccc(F)cc12
CCN(C)CCc1c[nH]c2ccc(F)cc12
Fc1cccc(c1)S(=O)(=O)n1ccc2c(nc3ccccc3c12)N1CCNCC1
c1ccc2c(c1)c3c(ccn3S(=O)(=O)c4cccc(c4)Cl)c(n2)N5CCNCC5
Cc1cccc(c1)S(=O)(=O)n1ccc2c(nc3ccccc3c12)N1CCNCC1
C(Cc1c[nH]c2ccccc12)N1CCC1
Oc1cccc2[nH]cc(CCN3CCC3)c12
COc1ccc2[nH]cc(CCN3CCC3)c2c1
CNCc1ccc(Cl)c(c1)-c1ccccc1OC
CCNCc1ccc(Cl)c(c1)-c1ccccc1OC
CCCNCc1ccc(Cl)c(c1)-c1ccccc1OC
CCCCNCc1ccc(Cl)c(c1)-c1ccccc1OC
COc1ccccc1-c1cc(CN(C)C)ccc1Cl
CCN(CC)Cc1ccc(Cl)c(c1)-c1ccccc1OC
CCCN(CCC)Cc1ccc(Cl)c(c1)-c1ccccc1OC
CNCCc1ccc(Cl)c(c1)-c1ccccc1OC
CCNCCc1ccc(Cl)c(c1)-c1ccccc1OC
CCCNCCc1ccc(Cl)c(c1)-c1ccccc1OC
CCCCNCCc1ccc(Cl)c(c1)-c1ccccc1OC
COc1ccccc1-c1cc(CCN(C)C)ccc1Cl
CCN(CC)CCc1ccc(Cl)c(c1)-c1ccccc1OC
CCCN(CCC)CCc1ccc(Cl)c(c1)-c1ccccc1OC
COc1ccccc1-c1cc(ccc1Cl)C1CCNC1
COc1ccccc1-c1cc(ccc1Cl)C1CCN(C)C1
Cc1cc(C)cc(c1)-c1nc(NC(=O)c2cccnc2)sc1-c1ccncc1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4ccc5ccccc5c4)C3)noc2c1
Cc1ccc(cc1C)S(=O)(=O)CC1CCN(CCCc2noc3cc(F)ccc23)C1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4ccc(F)c(F)c4)C3)noc2c1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4ccc(Cl)c(Cl)c4)C3)noc2c1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4ccc(F)c(Cl)c4)C3)noc2c1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4ccc(cc4)C(F)(F)F)C3)noc2c1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4cccc(c4)C(F)(F)F)C3)noc2c1
Fc1ccc(cc1)S(=O)(=O)CC1CCN(CCCc2noc3cc(F)ccc23)C1
Fc1cccc(c1)S(=O)(=O)CC1CCN(CCCc2noc3cc(F)ccc23)C1
Fc1ccc2c(CCCN3CCC(CS(=O)(=O)c4cccc(Cl)c4)C3)noc2c1
Cc1cccc(c1)S(=O)(=O)CC1CCN(CCCc2noc3cc(F)ccc23)C1
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1cccc(Cl)c1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1ccc(F)c(Cl)c1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1csc2ccccc12 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1cc2ccccc2s1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1cc2ccccc2o1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1cc2ccc(F)cc2s1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1cc2ccc(Cl)cc2s1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1sc2ccc(Cl)cc2c1C |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1ccc2ccccc2c1 |r|
C[C@H]1C[C@@H](CN1CCCc1noc2cc(F)ccc12)NS(=O)(=O)c1ccc2cc(Cl)ccc2c1 |r|
CN(C)CCN(Cc1ccc(cc1)-c1ccc(CNCCc2ccccc2)cc1)C(=O)CCC1CCCC1
[H][C@@]1(CC)CN2CCc3c([nH]c4cccc(OC)c34)[C@]2([H])C[C@]1([H])C(=C/OC)\C(=O)OC
[H][C@@]12C[C@@H]([C@@H](CC)CN1CCc1c2[nH]c2cccc(OC)c12)C(=C/OC)\C(=O)OC |r|
[H][C@@]12C[C@@H]([C@H](CN1CCc1c2[nH]c2cccc(OC)c12)C=C)C(=C/OC)\C(=O)OC |r|
CN(C)CCc1cn(CCF)c2cccc(O)c12
CCn1cc(CCN(C)C)c2c(O)cccc12
CN(C)CCc1cn(CC2CC2)c2cccc(O)c12
CCN(C)CCc1cn(C)c2cccc(O)c12
CC(C)N(C)CCc1cn(C)c2cccc(O)c12
CN(CCc1cn(C)c2cccc(O)c12)CC1CC1
[O-][S+](C1CCN(CCc2ccc(F)cc2F)CC1)c1ccc(F)cc1
CN1CN(c2ccccc2)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O
COc1cc(Br)c(OC)c(CCNCc2cccc(F)c2)c1
CCc1cc(OC)cc(CCNCc2cccc(F)c2)c1OC
COc1c(Br)cc([18F])cc1CCNCc1cccc2OCOc12
COc1c(Br)cc([18F])cc1CCNCc1ccccc1O
COc1ccccc1CNCCc1cc(OCC[18F])c(Br)cc1OC
COc1cc(CCNCc2ccccc2OC)c(OCC[18F])cc1Br
Cc1nc2SCCn2c(=O)c1CCN1CCC(CC1)C(=O)c1ccc(F)cc1
CN1CCC(CC1)n1c(C)c(-c2ccc(F)cc2)c2cc(C)ccc12
COc1ccc(cc1)C(=O)N(Cc1ccc(C)cc1)C1CCN(C)CC1
COc1cccc(CCc2ccccc2OCC[C@@H]2C[C@@H](O)CN2C)c1
CC1(CCN(CCCOc2ccc(F)cc2)CC1)NC(=O)c1ccc(N)cc1
COc1cc(CCNCc2ccccc2O[11CH3])c(OC)cc1Br
[2H]c4c([2H])c([2H])c([C@@H]3C[C@@H](N1CCN(C([2H])([2H])[2H])C(C)(C)C1)c2cc(Cl)ccc23)c([2H])c4[2H]
[2H]c4c([2H])c([2H])c([C@@H]3C[C@@H](N1CCNC(C)(C)C1)c2cc(Cl)ccc23)c([2H])c4[2H]
COc1cc(CCNC2COc3ccccc23)c(OC)cc1Br
COc1cc(CCNC2CCOc3ccccc23)c(OC)cc1Br
COc1ccccc1CNCCc1cc(OC)c(cc1OC)C#N
COc1cc(C#N)c(OC)cc1CCNCc1ccccc1F
COc1cc(C#N)c(OC)cc1CCNCc1cccc2OCOc12
COc1cc(C#N)c(OC)cc1CCNCc1cccc(O)c1
COc1cc(C#N)c(OC)cc1CCNC1COc2ccccc12
Nc1nc(N)nc(NCCCCN2CCN(CC2)c2ccccc2)n1
COc1ccccc1N1CCN(CCCCNc2nc(N)nc(N)n2)CC1
Nc1nc(N)nc(NCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)n1
Nc1nc(N)nc(NCCCCCN2CCN(CC2)c2ccccc2)n1
COc1ccccc1N1CCN(CCCCCNc2nc(N)nc(N)n2)CC1
Nc1nc(N)nc(NCCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)n1
Nc1nc(N)nc(NCCCCCCN2CCN(CC2)c2ccccc2)n1
COc1ccccc1N1CCN(CCCCCCNc2nc(N)nc(N)n2)CC1
Nc1nc(N)nc(NCCCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)n1
Nc1nc(NCCN2CCN(CC2)c2ccccc2)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCCCN2CCN(CC2)c2ccccc2)nc(NCCc2c[nH]c3ccccc23)n1
COc1ccccc1N1CCN(CCCCNc2nc(N)nc(NCCc3c[nH]c4ccccc34)n2)CC1
Nc1nc(NCCCCN2CCN(CC2)c2cccc(Cl)c2Cl)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCc2c[nH]c3ccccc23)nc(n1)N1CCN(CC1)c1ccccc1
COc1ccccc1N1CCN(CC1)c1nc(N)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCc2c[nH]c3ccccc23)nc(n1)N1CCN(CC1)c1cccc(Cl)c1Cl
Nc1nc(NCCNc2ccccc2)nc(NCCc2c[nH]c3ccccc23)n1
COc1ccccc1NCCNc1nc(N)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCNc2cccc(Cl)c2Cl)nc(NCCc2c[nH]c3ccccc23)n1
COc1ccccc1OCCNc1nc(N)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCOc2cccc(Cl)c2Cl)nc(NCCc2c[nH]c3ccccc23)n1
COc1ccccc1CCNc1nc(N)nc(NCCc2c[nH]c3ccccc23)n1
Nc1nc(NCCc2c[nH]c3ccccc23)nc(NCCc2cccc(Cl)c2Cl)n1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)-c1noc(C)n1)C(F)(F)F
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CCN(C)C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(CC(=O)N(C)C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CC(C2)N(C)C)cc1 |(6,6.54,;6,5,;7.33,4.23,;4.67,4.23,;4.67,2.69,;3.33,1.92,;2,2.69,;.67,1.93,;.67,.39,;-.67,-.38,;-2,.39,;-3.33,-.38,;-3.33,-1.92,;-4.67,.39,;-6,-.38,;-6,-1.92,;-4.67,-2.69,;-4.67,-4.23,;-6,-5,;-6,-6.54,;-7.33,-4.24,;-7.33,-2.69,;-4.67,1.93,;-5.77,3.03,;-4.68,4.12,;-3.58,3.01,;-4.68,5.66,;-6.02,6.43,;-3.35,6.43,;2.01,-.39,;3.34,.39,)|
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCC(C2)N(C)C)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ncc(F)cc2F)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCCCF)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(CCC(F)(F)F)cc1
CC(C)Cc1ccc(CNC(=O)N(Cc2ccc(F)cn2)C2CCN(C)CC2)cc1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)c(Cl)c1
CN1CCC(CC1)N(Cc1ccc(F)cn1)C(=O)NCc1ccc(OCC(F)(F)F)c(c1)C(F)(F)F
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCCC(C2)N(C)C)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2cccc3sccc23)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2cccc3[nH]cnc23)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2cn[nH]c2)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2c(C)noc2C)C2CCN(C)CC2)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)nc2)C2CCN(C)CC2)cc1
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1F
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1C(F)(F)F
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1Cl
COc1ccccc1C1NCCc2c1[nH]c1ccc(O)cc21
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1O
Oc1cccc(c1)C1NCCc2c1[nH]c1ccc(O)cc21
Oc1ccc(cc1)C1NCCc2c1[nH]c1ccc(O)cc21
Cc1cccc(c1)C1NCCc2c1[nH]c1ccc(O)cc21
Cc1ccc(cc1)C1NCCc2c1[nH]c1ccc(O)cc21
COc1ccc(C2NCCc3c2[nH]c2ccc(O)cc32)c(O)c1
Oc1ccc2[nH]c3C(NCCc3c2c1)c1ccc(Br)cc1O
Oc1ccc2[nH]c3C(NCCc3c2c1)c1cc(F)ccc1O
Oc1ccc2[nH]c3C(NCCc3c2c1)c1cc(Cl)ccc1O
Oc1ccc2[nH]c3C(NCCc3c2c1)c1cc(Br)ccc1O
COc1cc(OC)c(cc1OC)C1NCCc2c1[nH]c1ccc(O)cc21
Oc1ccc2[nH]c3C(NCCc3c2c1)c1cccs1
Cn1ccnc1C1NCCc2c1[nH]c1ccc(O)cc21
Oc1ccc2[nH]c3C(NCCc3c2c1)c1cncnc1
Oc1ccc2[nH]c3C(NCCc3c2c1)C1CCCCC1
Oc1ccc2[nH]c3C(CCc4ccccc4)NCCc3c2c1
Oc1ccc2[nH]c3C(Cc4ccccc4)NCCc3c2c1
CCC1NCCc2c1[nH]c1ccc(O)cc21
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1
Fc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1
Fc1ccccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Fc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1F
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1Cl
Fc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1Cl
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1Br
Fc1ccc2[nH]c3C(NCCc3c2c1)c1ccccc1Br
COc1ccccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1ccccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1ccccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1ccccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1cccc(c1)C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1cccc(c1)C1NCCc2c1[nH]c1ccc(F)cc21
Oc1ccc(cc1)C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1ccc(cc1)C1NCCc2c1[nH]c1ccc(F)cc21
Cc1cccc(c1)C1NCCc2c1[nH]c1ccc(Cl)cc21
Cc1cccc(c1)C1NCCc2c1[nH]c1ccc(F)cc21
Cc1ccc(cc1)C1NCCc2c1[nH]c1ccc(Cl)cc21
Cc1ccc(cc1)C1NCCc2c1[nH]c1ccc(F)cc21
Fc1ncccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Fc1ccc2[nH]c3C(NCCc3c2c1)c1cccnc1F
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccncc1Cl
Clc1ccc2[nH]c3C(NCCc3c2c1)c1cncnc1
Fc1ccc2[nH]c3C(NCCc3c2c1)c1cncnc1
Cc1noc(C)c1C1NCCc2c1[nH]c1ccc(Cl)cc21
Cc1noc(C)c1C1NCCc2c1[nH]c1ccc(F)cc21
Clc1ccc2[nH]c3C(NCCc3c2c1)c1cccs1
Fc1ccc2[nH]c3C(NCCc3c2c1)c1cccs1
Clc1ccc(s1)C1NCCc2c1[nH]c1ccc(Cl)cc21
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccc(Br)s1
Cc1cc(sc1Br)C1NCCc2c1[nH]c1ccc(Cl)cc21
Clc1ccc2[nH]c3C(NCCc3c2c1)c1cc2ccccc2s1
Fc1ccc2[nH]c3C(NCCc3c2c1)c1cc2ccccc2s1
Clc1ccc2[nH]c3C(NCCc3c2c1)c1ccc2ccccc2c1
Fc1ccc2[nH]c3C(NCCc3c2c1)c1ccc2ccccc2c1
COc1ccc2cc(ccc2c1)C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1ccc2cc(ccc2c1)C1NCCc2c1[nH]c1ccc(F)cc21
Clc1ccc2[nH]c3C(NCCc3c2c1)C(c1ccccc1)c1ccccc1
Fc1ccc2[nH]c3C(NCCc3c2c1)C(c1ccccc1)c1ccccc1
Clc1ccc2[nH]c3C(NCCc3c2c1)C1CCCCC1
Fc1ccc2[nH]c3C(NCCc3c2c1)C1CCCCC1
Clc1ccc2[nH]c3C(NCCc3c2c1)C1CCOCC1
Fc1ccc2[nH]c3C(NCCc3c2c1)C1CCOCC1
Clc1ccc2[nH]c3C(CCc4ccccc4)NCCc3c2c1
Fc1ccc2[nH]c3C(CCc4ccccc4)NCCc3c2c1
Clc1ccc2[nH]c3C(Cc4ccccc4)NCCc3c2c1
Fc1ccc2[nH]c3C(Cc4ccccc4)NCCc3c2c1
CCC1NCCc2c1[nH]c1ccc(Cl)cc21
CCC1NCCc2c1[nH]c1ccc(F)cc21
CCCC1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1c(Cl)cccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1c(Cl)cccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1c(Br)cccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1c(Br)cccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1cc(Cl)ccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1cc(Cl)ccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1cc(Br)ccc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1cc(Br)ccc1C1NCCc2c1[nH]c1ccc(F)cc21
Oc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1
COc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)c(OC)c1
COc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(O)c1
COc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)c(O)c1
Cc1ccc(C2NCCc3c2[nH]c2ccc(Cl)cc32)c(C)c1
Cc1ccc(C2NCCc3c2[nH]c2ccc(F)cc32)c(C)c1
Oc1ccc(Br)cc1C1NCCc2c1[nH]c1ccc(Cl)cc21
Oc1ccc(Br)cc1C1NCCc2c1[nH]c1ccc(F)cc21
Cc1ccc(O)c(c1)C1NCCc2c1[nH]c1ccc(F)cc21
Oc1ccc(O)c(c1)C1NCCc2c1[nH]c1ccc(F)cc21
COc1ccc(OC)c(c1)C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1cc(OC)c(cc1OC)C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1cc(OC)c(cc1OC)C1NCCc2c1[nH]c1ccc(F)cc21
COc1ccc(cc1OC)C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1ccc(cc1OC)C1NCCc2c1[nH]c1ccc(F)cc21
CCCC1NCCc2c1[nH]c1ccc(F)cc21
Oc1ccc(Cl)cc1C1NCCc2c1[nH]c1ccc(Cl)cc21
COc1ccc(OC)c(c1)C1NCCc2c1[nH]c1ccc(F)cc21
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCC=C)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCCCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCCCCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCCCCCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OC(C)C)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OC(C)CC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OC(C)CCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OC(C)CCCC)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCC4CC4)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OC4CCCCC4)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCc4ccc(Br)cc4)cc(CCN1C)c23 |r|
[H][C@@]12Cc3cc(OC)c(OC)cc3-c3c(OC)c(OCc4ccccc4)cc(CCN1C)c23 |r|
Clc1cccc(N2CCN(CCCN3CCN(CC3)c3ncccc3C#N)CC2)c1Cl
N#Cc1cccnc1N1CCN(CCCN2CCN(CC2)c2ccccc2)CC1
COc1ccc(cc1)N1CCN(CCCN2CCN(CC2)c2ncccc2C#N)CC1
COc1ccccc1N1CCN(CCCN2CCN(CC2)c2ncccc2C#N)CC1
COc1ccccc1N1CCN(CCCN2CCN(CC2)C(=O)c2ccccc2)CC1
O=C(N1CCN(CCCN2CCN(CC2)c2ccccc2)CC1)c1ccccc1
COc1ccc(cc1)N1CCN(CCCN2CCN(CC2)C(=O)c2ccccc2)CC1
Clc1cccc(N2CCN(CCCN3CCN(CC3)C(=O)c3ccccc3)CC2)c1Cl
Clc1cccc(N2CCN(CCCN3CCN(CC3)C(=O)c3ccccn3)CC2)c1Cl
Clc1cccc(N2CCN(CCN3CCN(CC3)c3ncccc3C#N)CC2)c1Cl
COc1ccccc1N1CCN(CCN2CCN(CC2)C(=O)c2nn(C)c3ccccc23)CC1
Cn1nc(C(=O)N2CCN(CCN3CCN(CC3)c3cccc(Cl)c3Cl)CC2)c2ccccc12
COc1ccccc1N1CCN(CCCNC(=O)c2cnccn2)CC1
O=C1CCc2ccc(OCCCN3CCN(CC3)c3ncccc3C#N)cc2N1
O=C1CCc2ccc(OCCCCN3CCN(CC3)c3ncccc3C#N)cc2N1
O=C(N1CCN(CCCCOc2ccc3CCC(=O)Nc3c2)CC1)c1ccccn1
COc1cccc(c1)N1CCN(CC2CCN(C2)c2ncnc3cc(OC)c(OC)cc23)CC1
COc1cc2ncnc(N3CCC(CN4CCN(CC4)c4ccc(Cl)cc4)C3)c2cc1OC
[2H]C1([2H])CC(c2c[nH]c3cccc(O)c23)C([2H])([2H])N1
[2H]C1([2H])CC(c2c[nH]c3cccc(OCc4ccccc4)c23)C([2H])([2H])N1
[2H]C1([2H])CC(c2c[nH]c3cccc(OCc4ccccc4)c23)C([2H])([2H])N1C
FC(F)(F)c1cccc(c1)N1CCN(CCCCCCn2nc3ccccn3c2=O)CC1
Clc1cccc(N2CCN(CCCCCCn3nc4ccccn4c3=O)CC2)c1Cl
O=c1n(CCCCCCN2CCN(CC2)c2cccc3ccccc23)nc2ccccn12
O=c1n(CCCCCCN2CCN(CC2)c2cccc3cccnc23)nc2ccccn12
O=c1n(CCCCCCN2CCN(CC2)c2cccc3OCCOc23)nc2ccccn12
Clc1cccc(c1)N1CCN(CC1)C(=O)NCCCCCCn1nc2ccccn2c1=O
Clc1cccc(c1)N1CCN(CC2CCC(Cn3nc4ccccn4c3=O)CC2)CC1 |(9.43,-.13,;8.67,-1.46,;9.43,-2.8,;8.67,-4.08,;7.12,-4.08,;6.36,-2.8,;7.12,-1.46,;4.82,-2.8,;4.05,-1.46,;2.51,-1.46,;1.75,-2.8,;.21,-2.8,;-.56,-1.46,;.21,-.13,;-.56,1.2,;-2.1,1.2,;-2.87,2.53,;-4.41,2.53,;-5.33,3.82,;-6.76,3.3,;-8.1,4.08,;-9.43,3.3,;-9.43,1.77,;-8.1,.99,;-6.76,1.77,;-5.33,1.3,;-4.82,-.13,;-2.87,-.13,;-2.1,-1.46,;2.51,-4.08,;4.05,-4.08,)|
Clc1cccc(c1)N1CCN(Cc2ccc(Cn3nc4ccccn4c3=O)cc2)CC1
Clc1ccc(cc1)N1CCN(Cc2ccc(Cn3nc4ccccn4c3=O)cc2)CC1
Clc1cccc(c1)N1CCN(CCCCCCn2c3cccc4CCCn(c34)c2=O)CC1
Clc1cccc(c1)N1CCN(CCCCCCn2c3cccc4CCCn(c34)c2=S)CC1
Clc1cccc(c1)N1CCN(CCCCCCN2c3cccc4CCCN(c34)S2(=O)=O)CC1
NC(=O)NCCCCCCN1CCN(CC1)c1cccc(Cl)c1
NS(=O)(=O)NCCCCCCN1CCN(CC1)c1cccc(Cl)c1
NC(=O)N1CCN(CC1)c1cccc(Cl)c1
Clc1cccc(c1)N1CCN(CCCCCCn2nc3ccccn3c2=O)CC1
O=C1C2C3CCC(C3)C2C(=O)N1CC1CCCCC1CN1CCN(CC1)c1nsc2ccccc12
CN1CCN(CC1)c1nc(N)nc(Cc2c[nH]c3ccccc23)n1
CCC(Oc1cccc(Cl)c1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CCC(Oc1cc(Cl)ccc1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(n1)C(C)(C)Sc1ccc2ccccc2c1
[H][C@]12C[C@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12 |r|
[H][C@]12C[C@@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)NC |r|
[H][C@]12C[C@@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NC(C3CC3)C3CC3)nc(Cl)nc12)C(=O)OCC |r|
COc1ccccc1N1CCN(CCCCn2c3CN(CCc3c3ccccc23)C(=O)C=C)CC1
COc1ccc(CC2NCCc3c2[nH]c2c(C)c(C)ccc32)c(Br)c1OC
COc1ccc2c3CCN=C(C)c3[nH]c2c1 |t:9|
COc1cc(C#N)c(OC)cc1CC1CCCC(N1)c1ccccc1O
COc1cc(C#N)c(OC)cc1C[C@H]1CCC[C@@H](N1)c1ccccc1O |r|
COc1cc(C#N)c(OC)cc1C[C@@H]1CCC[C@H](N1)c1ccccc1O |r|
CCN(CC)CCCC(C)Nc1cnc(cn1)C(=O)Nc1ccc(Cl)c2cccnc12
c1ccc2c(c1)CN(C2=O)CC3CCN(CC3)CC(=O)c4ccc(cc4)F
C(CN1CCN(CC1)c1ccccn1)Cc1nc2ccccc2s1
COc1ccccc1N1CCN(CCCCN2C(=O)C3C(C2=O)C2(C)C(=O)C3(C)C(=C2c2ccccc2)c2ccccc2)CC1 |c:32,THB:26:25:20.19:29.30|
CC12C3C(C(=O)N(CCCCN4CCN(CC4)c4ccccn4)C3=O)C(C)(C1=O)C(=C2c1ccccc1)c1ccccc1 |c:33,THB:28:27:3.2:30.29|
CC12C3C(C(=O)N(CCCCN4CCN(CC4)c4ccccc4Cl)C3=O)C(C)(C1=O)C(=C2c1ccccc1)c1ccccc1 |c:34,THB:29:28:3.2:31.30|
CC12C3C(C(=O)N(CCCCN4CCN(CC4)c4cccc(Cl)c4)C3=O)C(C)(C1=O)C(=C2c1ccccc1)c1ccccc1 |c:34,THB:29:28:3.2:31.30|
CC12C3C(C(=O)N(CCCCN4CCN(CC4)c4ccccc4F)C3=O)C(C)(C1=O)C(=C2c1ccccc1)c1ccccc1 |c:34,THB:29:28:3.2:31.30|
CC1Cc2cc(CNC(=O)N(Cc3ccc(F)cc3)C3CCN(C)CC3)ccc2O1
CC1COc2ccc(CNC(=O)N(Cc3ccc(F)cc3)C3CCN(C)CC3)cc12
[H][C@]12CNC[C@]1([H])CC(O)(C2)c1ccc(cc1)-c1cc(cc2cc(ccc12)-c1ccc(cc1)C(F)(F)F)C(O)=O |r|
OC(=O)c1cc(-c2ccc(cc2)C2CCCNCC2)c2ccc(cc2c1)-c1ccc(cc1)C(F)(F)F
CCC([Se]c1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CCCC([Se]c1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CCCCC([Se]c1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(n1)C(C)(C)[Se]c1ccccc1
CN1CCN(CC1)c1nc(N)nc(CCC[Se]c2ccccc2)n1
CC([Se]c1cc(C)ccc1C)c1nc(N)nc(n1)N1CCN(C)CC1
CCC([Se]c1cc(C)ccc1C)c1nc(N)nc(n1)N1CCN(C)CC1
CCCC([Se]c1cc(C)ccc1C)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(n1)C(C)(C)[Se]c1cc(C)ccc1C
CCCC([Se]c1cc(Cl)ccc1F)c1nc(N)nc(n1)N1CCN(C)CC1
CC([Se]c1cccc2ccccc12)c1nc(N)nc(n1)N1CCN(C)CC1
CCC([Se]c1cccc2ccccc12)c1nc(N)nc(n1)N1CCN(C)CC1
CC([Se]c1ccc2ccccc2c1)c1nc(N)nc(n1)N1CCN(C)CC1
CCC([Se]c1ccc2ccccc2c1)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(n1)C(C)(C)[Se]c1ccc2ccccc2c1
CN1CCN(CC1)c1nc(N)nc(C[Se]Cc2ccccc2)n1
CC([Se]Cc1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CCC([Se]Cc1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(CC1)c1nc(N)nc(CCC[Se]Cc2ccccc2)n1
NC[C@@H]1C[C@@H]1c1cc(F)ccc1OCC1CC1 |r|
NC[C@@H]1C[C@@H]1c1cc(O)ccc1OCC1CC1 |r|
CC1(C)Cc2cc(Cl)cc([C@H]3C[C@H]3CN)c2O1 |r|
CCCN1CCN(CC1)c1ccc2CCCC(N(C)C(=O)OCc3ccccc3)c2c1
CCOP(=O)(OCC)c1ccc2[nH]cc(CCN(C)C)c2c1
COc1ccccc1N1CCN(CCCNC(=O)Nc2ccccc2-c2ccccc2)CC1
COCCOCCOc1ccc(NC(=O)NCCCN2CCN(CC2)c2ccccc2OC)c(c1)-c1ccccc1
COc1ccccc1N1CCN(CCCNC(=O)Nc2ccccc2-c2ccc(cc2)-c2ccccc2)CC1
COc1ccccc1N1CCN(CCCNC(=O)NCc2ccccc2-c2ccccc2)CC1
COc1ccc(c(CNC(=O)NCCCN2CCN(CC2)c2ccccc2OC)c1)-c1ccccc1
Brc1ccc2[nH]nc(C3=CCCNC3)c2c1 |t:8|
O=C(NCCCCN1CCN(CC1)c1ccccc1)c1n[nH]c2ccccc12
COc1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
COc1cccc(c1)N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
COc1ccc(cc1)N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
O=C(NCCCCN1CCN(CC1)c1ccccn1)c1n[nH]c2ccccc12
O=C(NCCCCN1CCN(CC1)c1ncccn1)c1n[nH]c2ccccc12
Fc1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
Fc1cccc(c1)N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
Fc1ccc(cc1)N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
FC(F)(F)c1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
Clc1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
CSc1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
CCOc1ccccc1N1CCN(CCCCNC(=O)c2n[nH]c3ccccc23)CC1
FC(F)(F)c1cccc(c1)N1CCN(CCCNC(=O)c2n[nH]c3ccccc23)CC1
[H][C@]12Cc3c(OC)c(OC)ccc3-c3c4OCOc4cc(CCN1C)c23
CN1CCC=C(C1)c1c[nH]c2nccc(C)c12 |c:4|
COc1ccnc2[nH]cc(C3=CCCN(C)C3)c12 |t:10|
Cc1cccc2[nH]cc(C3=CCCNC3)c12 |t:9|
COc1cccc2[nH]cc(C3=CCCNC3)c12 |t:10|
COc1cccc2[nH]cc(C3=CCCN(C)C3)c12 |t:10|
C1CC=C(CN1)c1c[nH]c2cccc(-c3ccccc3)c12 |c:2|
Clc1ccc2[nH]cc(C3=CCCNC3)c2c1 |t:8|
CC(C)c1ccc2[nH]cc(C3=CCCNC3)c2c1 |t:10|
Fc1ccc2c(n[nH]c2c1)C1=CCCNC1 |t:12|
COc1cccc2[nH]nc(C3=CCCNC3)c12 |t:10|
Clc1ccc2[nH]nc(C3=CCCNC3)c2c1 |t:8|
Fc1ccc2[nH]nc(C3=CCCNC3)c2c1 |t:8|
CN1CCC=C(C1)c1n[nH]c2cc(F)ccc12 |c:4|
CN1CCC=C(C1)c1c[nH]c2c(Cl)c(F)ccc12 |c:4|
CN1CCC=C(C1)c1n[nH]c2c(Cl)cc(F)cc12 |c:4|
Fc1ccc(Cl)c2[nH]nc(C3=CCCNC3)c12 |t:10|
CN1CCC=C(C1)c1n[nH]c2c(Cl)ccc(F)c12 |c:4|
C1CC=C(CN1)c1c[nH]c2cnccc12 |c:2|
Clc1cccc(N2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)c3ccnc4ccccc34)CC2)c1Cl |r,wU:15.18,wD:12.11,(-10.78,3.33,;-10.01,2.01,;-10.78,.67,;-10.01,-.67,;-8.47,-.67,;-7.7,.67,;-6.16,.67,;-5.39,-.67,;-3.85,-.67,;-3.08,.67,;-1.54,.67,;-.77,-.67,;.77,-.67,;1.54,-2,;3.08,-2,;3.85,-.67,;3.08,.67,;1.54,.67,;5.39,-.67,;6.16,.67,;5.39,2,;7.7,.67,;8.47,2,;10,2,;10.77,.66,;10.01,-.67,;10.78,-1.99,;10.02,-3.34,;8.49,-3.34,;7.71,-2.02,;8.47,-.67,;-3.85,2,;-5.39,2,;-8.48,2.01,;-7.71,3.34,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:7.6,wD:10.10,(10.78,2.66,;10.01,1.33,;8.47,1.33,;7.7,-0,;6.16,-0,;5.39,1.33,;5.39,-1.34,;3.85,-1.34,;3.08,-2.67,;1.54,-2.67,;.77,-1.34,;-.77,-1.34,;-1.54,-0,;-3.08,-0,;-3.85,-1.34,;-5.39,-1.34,;-6.16,-0,;-5.39,1.33,;-3.85,1.33,;-7.7,-0,;-8.47,-1.33,;-10,-1.33,;-10.78,-0,;-10.01,1.34,;-10.78,2.66,;-8.47,1.34,;-7.7,2.67,;1.54,-0,;3.08,-0,)|
CCc1cccc(N2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)c3ccnc4ccccc34)CC2)c1Cl |r,wU:16.19,wD:13.12,(-11.55,3.33,;-10.01,3.33,;-9.24,2.01,;-10.01,.67,;-9.24,-.67,;-7.7,-.67,;-6.93,.67,;-5.39,.67,;-4.62,-.67,;-3.08,-.67,;-2.31,.67,;-.77,.67,;-0,-.67,;1.54,-.67,;2.31,-2,;3.85,-2,;4.62,-.67,;3.85,.67,;2.31,.67,;6.16,-.67,;6.93,.67,;6.16,2,;8.47,.67,;9.24,2,;10.77,2,;11.54,.66,;10.78,-.67,;11.55,-1.99,;10.79,-3.34,;9.26,-3.34,;8.48,-2.02,;9.24,-.67,;-3.08,2,;-4.62,2,;-7.71,2.01,;-6.94,3.34,)|
CCc1cccc(N2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)COC)CC2)c1Cl |r,wU:16.19,wD:13.12,(-11.17,2.66,;-9.63,2.66,;-8.86,1.34,;-9.62,-0,;-8.85,-1.33,;-7.31,-1.33,;-6.54,-0,;-5,-0,;-4.23,-1.34,;-2.69,-1.34,;-1.92,-0,;-.38,-0,;.39,-1.34,;1.93,-1.34,;2.7,-2.67,;4.24,-2.67,;5.01,-1.34,;4.24,-0,;2.7,-0,;6.55,-1.34,;7.32,-0,;6.55,1.33,;8.86,-0,;9.63,1.33,;11.17,1.33,;-2.69,1.33,;-4.23,1.33,;-7.32,1.34,;-6.55,2.67,)|
COc1cccc(N2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)N(C)C)CC2)c1F |r,wU:16.19,wD:13.12,(-10.4,2.66,;-8.86,2.66,;-8.09,1.34,;-8.85,-0,;-8.08,-1.33,;-6.54,-1.33,;-5.77,-0,;-4.23,-0,;-3.46,-1.34,;-1.92,-1.34,;-1.15,-0,;.39,-0,;1.16,-1.34,;2.7,-1.34,;3.47,-2.67,;5.01,-2.67,;5.78,-1.34,;5.01,-0,;3.47,-0,;7.32,-1.34,;8.09,-0,;7.32,1.33,;9.63,-0,;10.4,1.33,;10.4,-1.34,;-1.92,1.33,;-3.46,1.33,;-6.55,1.34,;-5.78,2.67,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(OC)c2F)CC1 |r,wU:7.6,wD:10.10,(11.55,2.66,;10.78,1.33,;9.24,1.33,;8.47,-0,;6.93,-0,;6.16,1.33,;6.16,-1.34,;4.62,-1.34,;3.85,-2.67,;2.31,-2.67,;1.54,-1.34,;0,-1.34,;-.77,-0,;-2.31,-0,;-3.08,-1.34,;-4.62,-1.34,;-5.39,-0,;-4.62,1.33,;-3.08,1.33,;-6.93,-0,;-7.7,-1.33,;-9.24,-1.33,;-10.01,-0,;-9.24,1.34,;-10.01,2.66,;-11.55,2.66,;-7.7,1.34,;-6.93,2.67,;2.31,-0,;3.85,-0,)|
FC(F)(F)c1cccc(n1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccnc3ccccc23)CC1 |r,wU:19.23,wD:16.16,(-11.56,2.67,;-10.02,2.67,;-9.25,4,;-10.79,4,;-9.25,1.33,;-10.01,.01,;-9.24,-1.33,;-7.7,-1.33,;-6.93,0,;-7.71,1.33,;-5.39,0,;-4.62,-1.33,;-3.08,-1.33,;-2.31,0,;-.77,0,;-0,-1.33,;1.54,-1.33,;2.31,-2.66,;3.85,-2.66,;4.62,-1.33,;3.85,0,;2.31,0,;6.16,-1.33,;6.93,0,;6.16,1.34,;8.47,0,;9.24,1.34,;10.78,1.34,;11.55,0,;10.78,-1.34,;11.56,-2.65,;10.79,-4,;9.26,-4,;8.48,-2.68,;9.24,-1.34,;-3.08,1.34,;-4.62,1.34,)|
COCCC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(n2)C(F)(F)F)CC1 |r,wU:7.6,wD:10.10,(11.55,2,;10.78,.67,;9.24,.67,;8.47,-.67,;6.93,-.67,;6.16,.67,;6.16,-2,;4.62,-2,;3.85,-3.33,;2.31,-3.33,;1.54,-2,;0,-2,;-.77,-.67,;-2.31,-.67,;-3.08,-2,;-4.62,-2,;-5.39,-.67,;-4.62,.67,;-3.08,.67,;-6.93,-.67,;-7.7,-2,;-9.24,-2,;-10.01,-.66,;-9.24,.67,;-7.7,.67,;-10.01,2,;-11.55,2,;-9.24,3.33,;-10.78,3.33,;2.31,-.67,;3.85,-.67,)|
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)N(C)C)CC1 |r,wU:20.24,wD:17.17,(-8.85,-4,;-9.62,-2.67,;-8.85,-1.34,;-9.62,-0,;-8.86,1.34,;-9.63,2.66,;-7.32,1.34,;-6.55,2.67,;-7.32,4,;-6.54,-0,;-7.31,-1.34,;-5,-0,;-4.23,-1.34,;-2.69,-1.34,;-1.92,-0,;-.38,-0,;.39,-1.34,;1.93,-1.34,;2.7,-2.67,;4.24,-2.67,;5.01,-1.34,;4.24,-0,;2.7,-0,;6.55,-1.34,;7.32,-0,;6.55,1.33,;8.86,-0,;9.63,1.33,;9.63,-1.34,;-2.69,1.33,;-4.23,1.33,)|
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)NC)CC1 |r,wU:20.24,wD:17.17,(-8.85,-4,;-9.62,-2.67,;-8.85,-1.34,;-9.62,-0,;-8.86,1.34,;-9.63,2.66,;-7.32,1.34,;-6.55,2.67,;-7.32,4,;-6.54,-0,;-7.31,-1.34,;-5,-0,;-4.23,-1.34,;-2.69,-1.34,;-1.92,-0,;-.38,-0,;.39,-1.34,;1.93,-1.34,;2.7,-2.67,;4.24,-2.67,;5.01,-1.34,;4.24,-0,;2.7,-0,;6.55,-1.34,;7.32,-0,;6.55,1.33,;8.86,-0,;9.63,1.33,;-2.69,1.33,;-4.23,1.33,)|
CCc1cc(Cl)c(OC)c(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)CCOC)CC1 |r,wU:20.24,wD:17.17,(-10.01,-4,;-10.78,-2.67,;-10.01,-1.34,;-10.78,-0,;-10.01,1.34,;-10.78,2.66,;-8.47,1.34,;-7.7,2.67,;-8.47,4,;-7.7,-0,;-8.47,-1.34,;-6.16,-0,;-5.39,-1.34,;-3.85,-1.34,;-3.08,-0,;-1.54,-0,;-.77,-1.34,;.77,-1.34,;1.54,-2.67,;3.08,-2.67,;3.85,-1.34,;3.08,-0,;1.54,-0,;5.39,-1.34,;6.16,-0,;5.39,1.33,;7.7,-0,;8.47,1.33,;10.01,1.33,;10.78,2.66,;-3.85,1.33,;-5.39,1.33,)|
[H][C@]12C[C@]3([H])CC1[C@@]2(C)[C@]3(C)CC\C=C(\C)CO |r,wU:1.0,wD:7.9,9.12,3.3,TLB:10:9:2:6.5,11:9:2:6.5,THB:8:7:2:6.5,(-4.28,-3.01,;-3.9,-1.51,;-3.9,1.15,;-3.08,-.18,;-2.7,1.31,;-4.57,-.59,;-5.33,-1.92,;-2.42,-1.92,;-2.02,-3.41,;-1.6,-.59,;-.06,-.59,;-.83,.74,;.71,.74,;1.48,2.08,;3.02,2.08,;3.8,3.41,;3.79,.74,;5.33,.74,)|
COc1cc([C@H]2CCCNC2)c(OC)cc1Br
COc1cc(C(F)(F)F)c(OC)cc1[C@@H]1CCCNC1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccccc4)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCc4n[nH]c5cc(F)ccc45)CC[C@@H]32)N1
Cn1nc(CCCN2CC[C@H]3[C@@H](C2)c2cccc4c2N3CC(=O)N4)c2ccc(F)cc21
O=C1CN2c3c(cccc3[C@@H]3CN(CCCc4noc5cc(F)ccc45)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccc(F)c(F)c4)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccc(F)cc4F)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccc(F)c(O)c4)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccc(F)cc4O)CC[C@@H]32)N1
O=C1CN2c3c(cccc3[C@@H]3CN(CCCOc4ccc(F)cc4)CC[C@H]32)N1
CC1(C)C(=O)Nc2cccc3c2N1[C@H]1CCN(CCCOc2ccc(F)cc2)C[C@@H]31
O=C1CN2c3c(cccc3[C@H]3CN(CCCOc4ccc(F)cc4)CC[C@H]32)N1
Oc1cccc(N2[C@@H]3CC[C@H]2CN(CCCc2ccccc2)C3)c1
c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F
OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5Cc6c7c(cccc7[nH]c6Br)C5=C4)C)O
Cc1ccc(NC(=O)C[C@H](CCC(O)=O)c2noc([C@@H]3C[C@H](CC(C)(C)C)C3)c2C2CC2)c(Cl)c1 |r,wU:19.18,21.21,wD:9.9,(16.24,-21,;15.33,-19.75,;13.8,-19.91,;12.9,-18.67,;13.53,-17.27,;12.62,-16.02,;11.09,-16.18,;10.19,-14.93,;10.46,-17.58,;8.93,-17.74,;8.3,-19.15,;9.21,-20.4,;8.58,-21.8,;7.05,-21.97,;9.48,-23.05,;8.03,-16.5,;8.51,-15.03,;7.26,-14.12,;6.02,-15.03,;4.54,-14.56,;3.84,-13.19,;2.47,-13.89,;1.01,-13.41,;.68,-11.91,;-.79,-11.43,;1.83,-10.88,;.28,-10.41,;3.17,-15.26,;6.49,-16.5,;5.58,-17.74,;4.17,-18.37,;5.41,-19.28,;15.05,-17.1,;15.67,-15.69,;15.96,-18.34,)|
COc1cc(SC(F)F)c(OC)cc1CCN
COc1cc([S+]([O-])C(F)(F)F)c(OC)cc1CCN
COc1cc(S(=O)(=O)C(F)(F)F)c(OC)cc1CCN
COc1cc([S+]([O-])C(F)F)c(OC)cc1CCN
COc1cc(S(=O)(=O)C(F)F)c(OC)cc1CCN
COc1cc(S(=O)(=O)CF)c(OC)cc1CCN
COc1cc(SSC(F)(F)F)c(OC)cc1CCN
COc1cc(SSC(C)(C)C)c(OC)cc1CCN
COc1cc(SCC(F)(F)C(F)F)c(OC)cc1CCN
COc1cc(OCCC(F)(F)F)c(OC)cc1CCN
COc1cc(OCCC(F)F)c(OC)cc1CCN
COc1cc([Se]C(F)(F)F)c(OC)cc1CCN
C#CCCCSc1cc(OC)c(CCN)cc1OC
COc1cc(SCC#N)c(OC)cc1CCN
COc1cc(CCN)cc(OC)c1SC(F)(F)F
COc1cc(SC(F)(F)F)c(OC)cc1CC(C)N
COc1cc(SCCCCF)c(OC)cc1CCN
COc1ccc2c3ccnc(C)c3n(CCN(C)C)c2c1
COc1ccc(OC)c(/C=C2N=C(N)NC2=O)c1
COc1cc(/C=C2N=C(N)NC2=O)c(OC)cc1Br
COc1ccc(OC)c(/C=C2C(=O)N=C(N)N2C)c1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@@H]2F)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)[C@H]2CCN(C)C[C@H]2F)cc1
CC(C)COc1ccc(cc1)CNC(=O)N(Cc2ccc(cc2)F)[C@H]3CCN(CC34CC4)C
CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cn2)[C@H]2CCN(C)CC23CC3)cc1
CC(C)COc1ccc(CNC(=O)N(Cc2ccn(C)n2)[C@H]2CCN(C)CC23CC3)cc1
CCCOc1ccc(CNC(=O)N(Cc2ccn(C)n2)[C@H]2CCN(C)CC23CC3)cc1
CCCOc1ccc(CNC(=O)N(Cc2ccn(C)n2)C2CCN(C)CC2)cc1
O=C(O)c1ccc2nc(CN3CCC(c4cccc(OCc5ccc(C6COC6)cc5F)n4)CC3)n(C[C@@H]3CCO3)c2c1
O=S(=O)(c1ccccc1)n1cccc1-c1cccc(N2CCNCC2)c1
O=S(=O)(c1cccc(NC2CCNCC2)c1)n1cccc1-c1ccccc1
O=S(=O)(c1cccc(N2CCNCC2)c1)n1cccc1-c1ccccc1
O=S(=O)(c1cccc(N2CCNCC2)c1)n1cccc1-c1cccc(F)c1
COc1cccc(-c2cccn2S(=O)(=O)c2cccc(N3CCNCC3)c2)c1
O=C(NC1CCNCC1)c1ccn(S(=O)(=O)c2cccc(Cl)c2)c1-c1cccc(F)c1
CC(=O)N1CCCC(N2C(=O)c3cccc(N)c3C2=O)C1
CS(=O)(=O)N1CCCC(N2C(=O)c3cccc(N)c3C2=O)C1
c1ccc2c(c1)nnn2CCCCN1CCN(c2nsc3ccccc23)CC1
C#CCN(C)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
C#CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCN(CC#N)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCN(CCF)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCN(CC(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CCN(CC(F)(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CN(CC(F)(F)F)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
CN1C[C@H](C(=O)N(CCF)CC(F)F)C=C2c3cccc4[nH]cc(c34)C[C@H]21
CN1C[C@H](C(=O)N(CC(F)F)CC(F)F)C=C2c3cccc4[nH]cc(c34)C[C@H]21
O[C@H]1[C@H](n2cnc3c(NC(C4CCCC4)C4CCCC4)nc(Cl)nc32)[C@H]2C[C@@]2(CCl)[C@H]1O
CSC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NC(C4CCCC4)C4CCCC4)nc(SC)nc31)[C@H](O)[C@@H]2O
CC(Oc1cc(Cl)ccc1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CC(Oc1ccc(Cl)c(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
CC(Oc1cc(Cl)cc(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
CCC(Oc1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
CCC(Oc1ccc(Cl)c(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
CCC(Oc1cc(Cl)cc(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
CCCC(Oc1cc(Cl)ccc1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CCCC(Oc1cc(Cl)cc(Cl)c1)c1nc(N)nc(n1)N1CCN(C)CC1
CCCC(Oc1cccc(Cl)c1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CCCCC(Oc1cccc(Cl)c1Cl)c1nc(N)nc(n1)N1CCN(C)CC1
CN1CCN(c2nc(N)nc(C(C)(C)Oc3ccccc3Cl)n2)CC1
CN1CCN(c2nc(N)nc(C(C)(C)Sc3ccccc3Cl)n2)CC1
CC(Sc1cc(Cl)cc(Cl)c1)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Sc1ccccc1)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Sc1cc(Cl)ccc1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Sc1ccc(Cl)c(Cl)c1)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Sc1cc(Cl)cc(Cl)c1)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Sc1cccc(Cl)c1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CCCC(Sc1cc(Cl)cc(Cl)c1)c1nc(N)nc(N2CCN(C)CC2)n1
CCCCC(Sc1cccc(Cl)c1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1ccccc1)c1nc(N)nc(N2CCNCC2)n1
CCC(Oc1cc(Cl)ccc1Cl)c1nc(N)nc(N2CCNCC2)n1
CCC(Sc1cc(Cl)ccc1Cl)c1nc(N)nc(N2CCNCC2)n1
CCC(Oc1cccc(Cl)c1Cl)c1nc(N)nc(N2CCNCC2)n1
CCC(Sc1cccc(Cl)c1Cl)c1nc(N)nc(N2CCNCC2)n1
CC(Oc1cc(F)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(F)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cc(Cl)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(Cl)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cc(F)ccc1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(F)ccc1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cc(C(F)(F)F)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(C(F)(F)F)ccc1F)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cc(F)ccc1C(F)(F)F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(F)ccc1C(F)(F)F)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cc(C(F)(F)F)ccc1C(F)(F)F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(C(F)(F)F)ccc1C(F)(F)F)c1nc(N)nc(N2CCN(C)CC2)n1
COc1ccc(F)cc1OC(C)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(F)ccc1OC)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cccc(F)c1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cccc(F)c1F)c1nc(N)nc(N2CCN(C)CC2)n1
CC(Oc1cccc(Cl)c1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cccc(Cl)c1F)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cccc(F)c1Cl)c1nc(N)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(Cl)cc(Cl)c1)c1nc(Nc2ccccc2)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(Cl)cc(Cl)c1)c1nc(Nc2ccncc2)nc(N2CCN(C)CC2)n1
CCCCC(Oc1cc(Cl)cc(Cl)c1)c1nc(Nc2ccccc2)nc(N2CCN(C)CC2)n1
CCCCC(Oc1cc(Cl)cc(Cl)c1)c1nc(Nc2ccncc2)nc(N2CCN(C)CC2)n1
CCC(Oc1cccc(Cl)c1Cl)c1nc(Nc2ccccc2)nc(N2CCN(C)CC2)n1
CCC(Oc1cc(Cl)ccc1Cl)c1nc(Nc2ccccc2)nc(N2CCN(C)CC2)n1
O=C(Nc1ccnn1-c1ccccc1)Nc1ccc(OCCN2CCOCC2)c2ccccc12
CC(C)(C)c1cc(n(n1)C)NC(=O)Nc2ccc(cc2)Cl
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)CO
Cn1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccccc1)C(C)(C)C