581 SMILES Strings for Large envelope protein

Compound Name
SMILES String
COCCCOc1cc2[C@@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3CCC(C)(C)[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1OCc1ccccc1)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCc1ccccc1)[C@@H]1CCC(C)(C)[C@@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1OCC(F)(F)F)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCC(C)C)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCC1CC1)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COCCOc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1OCCCC#N)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCO)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCC(C)(C)CO)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCN1CCOCC1)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCN1CCCC1)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCN1CCCC1=O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
CCOC(=O)CCCOc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1OCCCC(O)=O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCSC)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCS(C)(=O)=O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCCCCO)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCCCCNC(=O)OC(C)(C)C)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCCCCN)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCCCCNC(C)=O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCCCCCCNS(C)(=O)=O)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COCCCOc1cc2[C@@H]3CCCCC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1Cl |r|
COCCCOc1cc2[C@H]3CCCCC[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1Cl |r|
COCCCOc1cc2[C@@H]3CN(CC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC)C(O)OCc1ccccc1 |r|
COCCCOc1cc2[C@H]3CN(CC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC)C(O)OCc1ccccc1 |r|
COc1cc-2c(cc1OCc1ccccc1)[C@@H]1CCCC[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COc1cc-2c(cc1OCc1ccccc1)[C@@H]1CCCC[C@@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COCCOCc1cc2[C@@H]3COCC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCOCc1cc2[C@H]3COCC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@H]3CSCC[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3CSCC[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3CS(=O)(=O)CC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1C)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
CCc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
CCCc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COc1cc-2c(cc1N1CCCC1)[C@H]1CCC(C)(C)[C@H]1n1cc(C(O)=O)c(=O)cc-21 |r|
COCCCOc1cc2CC(c3ccccc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccsc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3cccs3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccc(O)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccc(OC)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccc(OCc4ccccc4)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3cc(C)cs3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3cccc(Cl)c3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccc(F)cc3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2CC(c3ccccc3C)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COc1ccc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)c1C
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCc1ccccc1
COc1cc2CC(c3cccs3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCC(C)C
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCC1CC1
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCn1cccn1
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCO
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCN1CCCCC1
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCC[N+]#[C-]
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCN1CCCC1=O
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCCCCNC(=O)OC(C)(C)C
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCCCCN
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCCCCNC(C)=O
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCCCCNS(C)(=O)=O
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCCCCO
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCC(C)(C)CO
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCC(F)(F)F
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCN1CCOCC1
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCn1cncn1
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCC(O)=O
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCSC
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1OCCCS(C)(=O)=O
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1C
CCc1cc2CC(c3cccs3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
CCCc1cc2CC(c3cccs3)n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COc1cc-2c(CC(c3cccs3)n3cc(C(O)=O)c(=O)cc-23)cc1N1CCCC1
COCCCOc1cc2CC(c3cc4ccccc4s3)n3cc(C(O)=O)c(=O)cc3-c2cc1Cl
COCCCOc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)c(F)c3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3CCC(C)(C)[C@@H]3n3cc(C(O)=O)c(=O)c(F)c3-c2cc1OC |r|
COCCCOc1cc2[C@H]3OCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3CCC(C)(C)[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1Cl |r|
COCCCOc1cc2[C@H]3CCC(C)(C)[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1Cl |r|
COCCCOc1cc2C3CCCC3n3cc(C(O)=O)c(=O)cc3-c2cc1OC
COCCCOc1cc2[C@H]3OCC(C)(C)C3n3cc(C(O)=O)c(=O)c(F)c3-c2cc1OC |r|
COCCCOc1cc2[C@@H]3OCC(C)(C)C3n3cc(C(O)=O)c(=O)c(F)c3-c2cc1OC |r|
COCCCOc1cc2[C@H]3COC(C)(C)C3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
COCCCOc1cc2C3CCCC(C)(C)C3n3cc(C(O)=O)c(=O)cc3-c2cc1OC
C1Cc2ccccc2CN1c1cnc(nc1)-c1ncccn1
Fc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
COc1cc2CCN(Cc2cc1OC)c1cnc(nc1)-c1ncccn1
COc1ccc2CN(CCc2c1)c1cnc(nc1)-c1ncccn1
COc1cc(F)c2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
COc1cc(F)cc2CN(CCc12)c1cnc(nc1)-c1ncccn1
COc1cc(F)c2CCN(C(C)c2c1)c1cnc(nc1)-c1ncccn1
COc1cc(F)c2CCN(Cc2c1)c1cnc(cn1)-c1ncccn1
Clc1ccc2CN(CCc2c1)c1cnc(nc1)-c1ncccn1
COc1cc2CCN(Cc2cc1OC)c1ccc(nc1)-c1ccccn1
COc1ccc2CCN(Cc2n1)c1cnc(nc1)-c1ncccn1
COc1cc2CN(CCc2cn1)c1cnc(nc1)-c1ncccn1
COc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
C1CC1c1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
CN(C)c1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
Cc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
CNc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
FC(F)COc1cc(F)c2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
N#Cc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
Fc1cc(OCC2CC2)cc2CN(CCc12)c1cnc(nc1)-c1ncccn1
Clc1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
CN(C)c1ccc2CN(CCc2c1)c1cnc(nc1)-c1ncccn1
C1CC1c1ccc2CN(CCc2c1)c1cnc(nc1)-c1ncccn1
N#Cc1cccc2CN(CCc12)c1cnc(nc1)-c1ncccn1
COC1CN(C1)c1ccc2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
Fc1cccc2CN(CCc12)c1cnc(nc1)-c1ncccn1
NC(=O)COc1cc(F)c2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
C1CC1c1cccc2CN(CCc12)c1cnc(nc1)-c1ncccn1
CN(C)c1cccc2CN(CCc12)c1cnc(nc1)-c1ncccn1
COc1cc(Cl)c2CCN(Cc2c1)c1cnc(nc1)-c1ncccn1
COc1cc(Cl)cc2CN(CCc12)c1cnc(nc1)-c1ncccn1
CCC1N(CCc2c(F)cc(OC)cc12)c1cnc(nc1)-c1ncccn1
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4cccc(c4)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4F)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(O)=O)nc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(Cc4ccc(cc4)-c4ccc(cc4)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)C(C)(C)c3ccc(cc3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(Oc4ccc(cc4F)C(O)=O)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4F)C(O)=O)cc3F)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,36|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4cccc(c4)C(O)=O)cn3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(cc3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3ccc(cc3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cn3)-c3ccc(cc3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)N3CCO[C@H](CCC(O)=O)C3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)N3CCC(CC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4F)C(O)=O)cn3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(OC4CCC(CC4)C(O)=O)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,wU:11.10,wD:37.42,c:4,39,(-5.67,7.32,;-4.45,6.38,;-3.03,6.97,;-2.83,8.5,;-1.81,6.03,;-2.01,4.51,;-3.44,3.92,;-3.64,2.39,;-5.06,1.81,;-5.27,.28,;-4.05,-.66,;-2.62,-.07,;-1.62,-1.25,;-2.43,-2.56,;-3.93,-2.2,;-5.1,-3.19,;-1.84,-3.98,;-2.78,-5.2,;-2.19,-6.62,;-3.13,-7.85,;-.67,-6.83,;.27,-5.61,;1.8,-5.81,;2.39,-7.23,;1.45,-8.46,;2.03,-9.88,;3.56,-10.08,;4.5,-8.86,;3.91,-7.44,;4.15,-11.51,;5.67,-11.71,;3.21,-12.73,;-.32,-4.18,;-2.42,1.45,;-.79,3.57,;.63,4.15,;.83,5.68,;-.39,6.62,;-.18,8.15,;-1.4,9.09,;-1.2,10.61,;.22,11.2,;.43,12.73,;1.44,10.26,;1.24,8.73,;2.46,7.79,;1.85,3.21,;3.33,3.65,;4.2,2.38,;3.26,1.16,;1.81,1.68,)|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C3(CC3)C#N)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C3(CC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C3(CCC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,35|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C3(CCCC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,36|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C3(CCCCC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)N3CCC(CC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(c3)N3CCC(CC3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(c(F)c3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(c(F)c3)-c3ccc(C(O)=O)c(F)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(c(F)c3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(CC(C)(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(CO)cc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)C(C)(C)O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)C(N)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
CONC(=O)c1ccc(cc1)C#CCN1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:24,t:21|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)S(C)(=O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)C(=O)N(C)C)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,35|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)S(=O)(=O)N(C)C)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,36|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4)C#N)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(OC)cc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4c(C)cc(cc4C)C#N)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(C(O)=O)c(OC)c4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,35|
COC(=O)C1=C(CN2CCN3[C@H](CN(CC#Cc4ccc(cc4OC)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,35|
COC(=O)C1=C(CN2CCN3[C@H](CN(CCC#Cc4ccc(OC=O)cc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N4CCOCC4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,44|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N4CCCC4(F)F)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,45|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N4CCC(CO)CC4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,46|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N4CC(O)C4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,43|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N(CCO)Cc4ccccc4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,49|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N(CCO)CCO)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,44|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)NC(C)(C)CO)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,43|
COCC(C)(C)NC(=O)c1ccc(Oc2ccc(cc2)N2C[C@@H]3CN(CC4=C([C@@H](N=C(N4)c4nccs4)c4ccc(F)cc4Cl)C(=O)OC)CCN3C2=O)cc1 |r,c:30,t:27|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)NCCCC(=O)N(C)C)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,46|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)NC(C)CO)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,42|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(=O)N4CCO[C@H](CCC(O)=O)C4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,49|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)N3CCOC(CC(O)=O)C3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)N3CCOC(C3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cn4)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4cc(F)cc(c4)C(O)=O)cn3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(=O)n(c3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(Oc4ccc(cc4F)C(O)=O)c3)C2)NC(=N[C@H]1c1cccc(F)c1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Sc4ccc(cc4)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(Oc4ccc(cc4F)C(O)=O)c3)C2)NC(=N[C@H]1c1ccccc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C#N)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Sc4ccc(cc4)C#N)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(CO)cc4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)C(C)(C)O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(CCC(O)=O)cc4F)cc3F)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,42|
COC(=O)C1=C(CN2CCN3[C@H](CN(Cc4ccc(Oc5ccc(cc5)C#N)cc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(OC)cc4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Sc4ccc(OC(C)C)cc4)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(Oc4ccc(cc4)S(C)(=O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3cnc(C)[nH]3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc4[nH]c(nc4c3)C3CCCN3C)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
CCc1c[nH]c(n1)-c1ccc(cc1)N1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:24,t:21|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3nc(c[nH]3)C3CCCCC3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3nc(c[nH]3)C3CC3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(OC4CCC(CC4)C(O)=O)cc3F)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,wU:11.10,wD:37.42,c:4,39,(-5,8.17,;-3.76,7.26,;-2.35,7.89,;-2.19,9.42,;-1.1,6.98,;-1.27,5.45,;-2.67,4.82,;-2.83,3.29,;-4.24,2.67,;-4.4,1.13,;-3.16,.23,;-1.75,.86,;-.72,-.29,;-1.49,-1.62,;-2.99,-1.3,;-4.14,-2.33,;-.86,-3.03,;-1.77,-4.28,;-1.14,-5.68,;.39,-5.84,;1.06,-7.34,;.15,-8.59,;-1.38,-8.43,;-2.28,-9.67,;-1.66,-11.08,;-.12,-11.24,;.78,-10,;-2.56,-12.33,;-1.93,-13.73,;-4.09,-12.17,;1.3,-4.6,;.67,-3.19,;1.58,-1.94,;-1.59,2.39,;-.02,4.54,;1.39,5.17,;1.55,6.7,;.3,7.61,;.46,9.14,;-.78,10.04,;-.62,11.58,;.79,12.2,;.95,13.73,;2.03,11.3,;1.87,9.77,;3.12,8.86,;2.63,4.27,;4.1,4.74,;5,3.5,;4.1,2.25,;2.63,2.73,)|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(F)c(c3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3cc(ccc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(c3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(c3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(c3)-c3ccc(C(O)=O)c(F)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)-c3ccc(C(O)=O)c(F)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(nc3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccnc(c3)-c3ccc(cc3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(nc3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(nc3)-c3ccc(cc3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)-c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cc(F)cc(c3)N3CCO[C@H](CCC(O)=O)C3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(CC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(cc3F)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3ccc(C(O)=O)c(F)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3cc(F)cc(c3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,37|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3cccc(c3)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,36|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(cs3)-c3cccc(CCC(O)=O)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,38|
COCCN1C[C@H](C[C@@H]1C(O)=O)N1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:22,t:19|
COC(=O)C1=C(CN2CCN3C(CN([C@H](Cc4ccccc4)C(O)=O)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C(CC(O)=O)c4ccccc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,31|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(CC(O)=O)NC(=O)OC(C)(C)C)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,40|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(C)(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(C)CC(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(CCC(O)=O)cs3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,31|
COC(=O)C1=C(CN2CCN3[C@H](CN(Cc4ccc(CC(O)=O)cc4)C3=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,33|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:5,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(Cl)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)CCc1ccc(cc1)N1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:22,t:19|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(Cl)cc1Cl)c1nccs1 |r,c:4,31|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(C)(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,35|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CC(C)(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:5,35|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(CCC(O)=O)cs3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:5,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(C)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,30|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)C(C)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,31|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3F)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3F)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cn3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cccc(CCC(O)=O)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cccc(c3)C(C)(C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3cccc(CC(O)=O)c3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,31|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(OC(C)(C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COCC(C)(C)NC(=O)CCc1ccc(cc1)N1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:27,t:24|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)C2)NC(=NC1c1ccc(F)cc1Cl)c1nccn1C |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(NC(=O)OC(C)(C)C)C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,39|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(\C=C\C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(N)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,32|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCCNS(C)(=O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,35|
COC[C@@H]1[C@H]2CN(C(=O)N2CCN1CC1=C([C@@H](N=C(N1)c1nccs1)c1ccc(F)cc1Cl)C(=O)OC)c1ccc(CCC(=O)OC)cc1 |r,c:19,t:16|
COC[C@@H]1[C@H]2CN(C(=O)N2CCN1CC1=C([C@@H](N=C(N1)c1nccs1)c1ccc(F)cc1Cl)C(=O)OC)c1ccc(CCC(O)=O)cc1 |r,c:19,t:16|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3nc(\C=C\C(O)=O)cs3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,31|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(\C=C(/C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(\C)=C\C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,33|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(\C=C(/C)C(O)=O)cc3)C2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,34|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(cc3)C(\C)=C\C(O)=O)C2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,34|
CCOC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)[C@H]2COC)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:5,36|
COC(=O)CCc1ccc(cc1)N1C[C@@H]2[C@@H](CO)N(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:24,t:21|
COC(=O)C1=C(CN2CCN3[C@H](CN(C3=O)c3ccc(CCC(O)=O)cc3)[C@H]2CO)NC(=N[C@H]1c1ccc(F)cc1Cl)c1nccs1 |r,c:4,34|
COC[C@@H]1[C@H]2CN(C(=O)N2CCN1CC1=C([C@@H](N=C(N1)c1nccs1)c1ccc(F)cc1Cl)C(=O)OC)c1ccc(cc1)C(C)(C)C(=O)OC |r,c:19,t:16|
COC[C@@H]1[C@H]2CN(C(=O)N2CCN1CC1=C([C@@H](N=C(N1)c1nccs1)c1ccc(F)cc1Cl)C(=O)OC)c1ccc(cc1)C(C)(C)OC=O |r,c:19,t:16|
CCC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CCCC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CCCCC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CC(C)CC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
COCCC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CC(C)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)C1CCCC1
Fc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Clc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Cc1cc(F)cc(c1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Cc1cc(Cl)cc(c1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Fc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Clc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
FC(F)(F)Oc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
FC(F)Oc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
FC(F)(F)Oc1cccc(c1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
FC(F)Oc1cccc(c1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1ccc(cc1)C#N
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1ccncc1
Clc1cc(ccn1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
COc1cc(ccn1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Clc1cccc(n1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Clc1ccc(nc1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1ccnnc1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1cccnn1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1ncco1
O=C(Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1)c1nccs1
CC(C)(C)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CC(C)(C)CC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccccc1
Cc1cc(ccc1N)-c1nnc(o1)-c1ccccc1
COc1cc(ccc1N)-c1nnc(o1)-c1ccccc1
Nc1ccc(cc1F)-c1nnc(o1)-c1ccccc1
CN(C)c1ccc(cc1)-c1nnc(o1)-c1ccccc1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccccn2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2cccnc2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccncc2)C1
Cc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(NC3COC3)c2)C1
CCN(CC)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CCN(C)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)N2CCCCC2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)N2CCOCC2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(NC3CC3)c2)C1
CN(C)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CC(C)N(C)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)N2CCCC2=O)C1
Cc1csc(n1)-c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Cc1cnc(s1)-c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)-c2nccs2)C1
COc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)C#N)C1
NS(=O)(=O)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CC(C)Oc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
FC(F)(F)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CNS(=O)(=O)Nc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CS(=O)(=O)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CS(=O)(=O)c1cncc(c1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
FC(F)(F)c1cccc(c1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
NS(=O)(=O)c1cccc(c1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
CP(C)(=O)c1cccc(c1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
FC(F)(F)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
Clc1ccc2sc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccnc(c2)C#N)C1
Cc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
CS(=O)(=O)Cc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
CC(C)(c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1)S(C)(=O)=O
CCS(=O)(=O)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
NC(=O)Nc1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
NC(=O)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
NC(=O)c1cc(ccn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc3OCOc3cc2s1
Clc1ccc2sc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)C2CC2)C1
FC(F)(F)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
FC(F)(F)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2ccc(Cl)cc2s1
CC(c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1)S(C)(=O)=O
CC(C)(c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1)S(C)(=O)=O
OC(c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1)C(F)(F)F
Nc1nc(cs1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
Clc1ccc2sc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)N2CCC2)C1
FC1(F)CN(C1)S(=O)(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
Clc1ccc2sc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)NC2CCC2)C1
FC1(F)CC(C1)NS(=O)(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
FC(F)(F)C1CC(C1)NS(=O)(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2s1
CS(=O)(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
CS(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
C[S@](=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1 |r|
C[S@@](=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1 |r|
CSc1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=O)C1CC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=O)(=O)C1CC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=O)CC1CC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=O)(=O)CC1CC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(Br)o1
NS(=O)(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=N)(=O)C1CC1
CS(=N)(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
C[S@@](=N)(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1 |r|
C[S@](=N)(=O)c1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1 |r|
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=N)(=O)CC1CC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=O)(=O)CC1COC1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(o1)S(=N)(=O)CC1COC1
CS(=O)(=O)Cc1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
CS(=N)(=O)Cc1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
NS(=O)(=O)Cc1ccc(o1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1cccc(Br)c1
Clc1ccc2oc(nc2c1)C12CC(C1)(C2)NC(=O)c1ccc(Br)cc1
CSc1cccc(c1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
CS(=O)(=O)c1cccc(c1)C(=O)NC12CC(C1)(C2)c1nc2cc(Cl)ccc2o1
FC(F)(F)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)C#N)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(Br)o2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2cc(Br)co2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2occc2Br)C1
Clc1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CC(C)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
COc1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
COCc1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
OC(C1CC1)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
NC(O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
FC(F)(F)c1cc([nH]n1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Cn1cc(cn1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CS(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CS(=O)(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
CS(=O)(=O)c1ccc(o1)C(=O)NC1C[C@@]2(C1)C[C@@H](C2)c1nc2cc(Cl)ccc2o1 |r|
CS(=O)(=O)c1ccc(o1)C(=O)NC1C[C@@]2(C1)C[C@@H](C2)c1nc2cc(Cl)ccc2o1 |r|
CCS(=O)(=O)c1ccc(o1)C(=O)NC1CC2(C1)CC(C2)c1nc2cc(Cl)ccc2o1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)C2CC2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)C2COC2)C1
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)CC2CC2)C1
Clc1ccc2oc(nc2c1)[C@H]1C[C@]2(C[C@@H](C2)NC(=O)c2ccc(o2)[S@@](=O)CC2CC2)C1 |r,wU:12.34,14.18,24.27,wD:10.11,(-4.5,4.71,;-3.17,5.48,;-3.17,7.02,;-1.83,7.79,;-.5,7.02,;.97,7.5,;1.87,6.25,;.97,5.01,;-.5,5.48,;-1.83,4.71,;3.41,6.25,;4.5,5.17,;5.59,6.25,;6.68,5.17,;7.77,6.25,;6.68,7.34,;9.31,6.25,;10.08,7.59,;9.31,8.92,;11.62,7.59,;12.52,6.34,;13.99,6.82,;13.99,8.36,;12.52,8.83,;15.23,9.26,;15.23,10.8,;16.57,8.49,;17.9,9.26,;18.53,10.67,;19.43,9.42,;4.5,7.34,)|
Clc1ccc2oc(nc2c1)[C@H]1C[C@]2(C[C@@H](C2)NC(=O)c2ccc(o2)[S@](=O)CC2CC2)C1 |r,wU:12.34,14.18,wD:10.11,24.27,(-4.5,4.71,;-3.17,5.48,;-3.17,7.02,;-1.83,7.79,;-.5,7.02,;.97,7.5,;1.87,6.25,;.97,5.01,;-.5,5.48,;-1.83,4.71,;3.41,6.25,;4.5,5.17,;5.59,6.25,;6.68,5.17,;7.77,6.25,;6.68,7.34,;9.31,6.25,;10.08,7.59,;9.31,8.92,;11.62,7.59,;12.52,6.34,;13.99,6.82,;13.99,8.36,;12.52,8.83,;15.23,9.26,;15.23,10.8,;16.57,8.49,;17.9,9.26,;18.53,10.67,;19.43,9.42,;4.5,7.34,)|
Clc1ccc2oc(nc2c1)[C@H]1C[C@@]2(C[C@@H](C2)NC(=O)c2ccc(o2)[S@@](=O)CC2CC2)C1 |r,wU:10.11,24.27,wD:12.13,14.18,(-4.5,4.71,;-3.17,5.48,;-3.17,7.02,;-1.83,7.79,;-.5,7.02,;.97,7.5,;1.87,6.25,;.97,5.01,;-.5,5.48,;-1.83,4.71,;3.41,6.25,;4.5,7.34,;5.59,6.25,;6.68,7.34,;7.77,6.25,;6.68,5.17,;9.31,6.25,;10.08,7.59,;9.31,8.92,;11.62,7.59,;12.52,6.34,;13.99,6.82,;13.99,8.36,;12.52,8.83,;15.23,9.26,;15.23,10.8,;16.57,8.49,;17.9,9.26,;18.53,10.67,;19.43,9.42,;4.5,5.17,)|
Clc1ccc2oc(nc2c1)[C@H]1C[C@@]2(C[C@@H](C2)NC(=O)c2ccc(o2)[S@](=O)CC2CC2)C1 |r,wU:10.11,wD:12.13,14.18,24.27,(-4.5,4.71,;-3.17,5.48,;-3.17,7.02,;-1.83,7.79,;-.5,7.02,;.97,7.5,;1.87,6.25,;.97,5.01,;-.5,5.48,;-1.83,4.71,;3.41,6.25,;4.5,7.34,;5.59,6.25,;6.68,7.34,;7.77,6.25,;6.68,5.17,;9.31,6.25,;10.08,7.59,;9.31,8.92,;11.62,7.59,;12.52,6.34,;13.99,6.82,;13.99,8.36,;12.52,8.83,;15.23,9.26,;15.23,10.8,;16.57,8.49,;17.9,9.26,;18.53,10.67,;19.43,9.42,;4.5,5.17,)|
Clc1ccc2oc(nc2c1)C1CC2(CC(C2)NC(=O)c2ccc(o2)S(=O)(=O)CC2CC2)C1
CCOP(=O)(CCOCc1ccc2c(NC(c3ccccc3)(c3ccccc3)c3ccccc3)ncnn12)OCC
CCOP(=O)(CO[C@H](C)Cc1ccc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)ncnn12)OCC |r|
CCOP(=O)(COC(C)Cc1ccc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)nc(F)nn12)OCC |w:7.7|
COc1ccc(cc1)C(Nc1nc(NC(c2ccccc2)(c2ccccc2)c2ccc(OC)cc2)c2ccc(I)n2n1)(c1ccccc1)c1ccccc1
CCOP(=O)(COC(CF)Cc1cnn2c(N)ncnc12)OCC |w:7.7|
CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cc1ccc2c(N)ncnn12)OCOC(=O)OC(C)C |r|
CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cc1cnc2c(N)ncnn12)OCOC(=O)OC(C)C |r|
CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cc1cnn2c(N)ncnc12)OCOC(=O)OC(C)C |r|
CC(C)OC(=O)OCOP(=O)(CO[C@@H](C)Cc1cnn2c(N)ncnc12)OCOC(=O)OC(C)C |r|
CC(C)OC(=O)OCOP(=O)(COCCc1ccc2c(N)ncnn12)OCOC(=O)OC(C)C
CC(C)OC(=O)OCOP(=O)(COC(CF)Cc1cnn2c(N)ncnc12)OCOC(=O)OC(C)C |w:13.13|
CC(C)OC(=O)OCOP(=O)(COC(C)Cc1ccc2c(N)nc(N)nn12)OCOC(=O)OC(C)C |w:13.13|
CC(Cc1cnc2n1nc(N)[nH]c2=O)OCP(O)(O)=O |w:1.0|
CC(C)OC(=O)OCOP(=O)(COC(C)Cc1ccc2n1nc(N)[nH]c2=O)OCOC(=O)OC(C)C |w:13.13|
CC(C)OC(=O)[C@H](C)NP(=O)(CO[C@H](C)Cc1cnn2c(N)ncnc12)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)NP(=O)(CO[C@H](C)Cc1cnc2c(N)ncnn12)Oc1ccccc1 |r,w:9.27|
CC(C)OC(=O)[C@H](C)NP(=O)(COC(C)Cc1cnc2n1nc(N)[nH]c2=O)Oc1ccccc1 |r,w:9.28,13.13|
CC(C)OC(=O)[C@H](C)NP(=O)(CO[C@@H](CF)Cc1cnn2c(N)ncnc12)Oc1ccccc1 |r,w:9.28|
CC(C)OC(=O)[C@H](C)NP(=O)(CO[C@H](CF)Cc1cnn2c(N)ncnc12)Oc1ccccc1 |r,w:9.28|
Nc1ncnc2c(CC3(CC3)OCP(O)(O)=O)cnn12
Nc1ncnc2c(C[C@H](OCP(O)(O)=O)C(F)F)cnn12 |r|
Nc1ncnc2c(C[C@@H](OCP(O)(O)=O)C(F)F)cnn12 |r|
Nc1ncnn2c(C[C@@H](CF)OCP(O)(O)=O)cnc12 |r|
Nc1ncnn2c(C[C@H](CF)OCP(O)(O)=O)cnc12 |r|
Cn1nc([C@@H]2CC[C@@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@@H]2CC[C@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@H]2CC[C@@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@H]2CC[C@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@H]2C[C@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,6.8,(-6.04,4.26,;-4.8,3.36,;-4.8,1.82,;-3.33,1.34,;-2.86,-.12,;-1.48,-.82,;-2.18,-2.19,;-3.56,-1.5,;-1.71,-3.66,;-2.74,-4.8,;-2.26,-6.27,;-.76,-6.59,;.27,-5.44,;-.2,-3.98,;-2.43,2.59,;-.89,2.59,;-.12,1.25,;-.12,3.92,;1.42,3.92,;2.19,2.59,;3.73,2.59,;4.5,3.92,;6.04,3.92,;3.73,5.25,;4.5,6.59,;2.19,5.25,;-3.33,3.83,;-2.86,5.3,)|
Cn1nc([C@H]2C[C@@H](C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:6.8,(-6.04,4.26,;-4.8,3.36,;-4.8,1.82,;-3.33,1.34,;-2.86,-.12,;-1.48,-.82,;-2.18,-2.19,;-3.56,-1.5,;-1.71,-3.66,;-2.74,-4.8,;-2.26,-6.27,;-.76,-6.59,;.27,-5.44,;-.2,-3.98,;-2.43,2.59,;-.89,2.59,;-.12,1.25,;-.12,3.92,;1.42,3.92,;2.19,2.59,;3.73,2.59,;4.5,3.92,;6.04,3.92,;3.73,5.25,;4.5,6.59,;2.19,5.25,;-3.33,3.83,;-2.86,5.3,)|
Cn1nc(C2CC3CCCC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CCN(C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
CN(C)C(=O)CC1(O)CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-2.41,-7.13,;-3.03,-5.72,;-2.13,-4.47,;-4.56,-5.56,;-5.47,-6.8,;-5.33,-4.22,;-4.56,-2.89,;-3.23,-3.66,;-3.23,-2.12,;-3.55,-.61,;-2.92,.79,;-4.07,1.82,;-5.4,1.05,;-5.08,-.45,;-5.71,-1.86,;-3.91,3.35,;-5.05,4.39,;-4.42,5.79,;-5.19,7.13,;-2.89,5.63,;-1.86,6.78,;-2.57,4.12,;-1.17,3.5,;-1.01,1.97,;.08,4.4,;1.49,3.78,;1.65,2.25,;3.05,1.62,;4.3,2.52,;5.71,1.9,;4.14,4.06,;5.39,4.96,;2.73,4.68,)|
COC(=O)CC1(O)CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-2.39,-7.06,;-3.11,-5.7,;-4.65,-5.64,;-5.47,-6.94,;-5.36,-4.28,;-4.52,-2.94,;-3.19,-3.71,;-5.68,-1.93,;-5.07,-.51,;-5.42,.99,;-4.09,1.78,;-2.93,.76,;-3.54,-.65,;-3.2,-2.15,;-3.95,3.31,;-5.11,4.33,;-4.51,5.74,;-5.3,7.06,;-2.97,5.6,;-1.96,6.76,;-2.63,4.1,;-1.22,3.5,;-1.03,1.97,;.02,4.42,;1.43,3.81,;1.62,2.28,;3.03,1.68,;4.26,2.6,;5.68,2,;4.08,4.13,;5.31,5.05,;2.66,4.74,)|
Cn1nc(C2CC3CC(O)(CS(=O)(=O)NC4CC4)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.1,8.45,;-4.33,7.11,;-4.96,5.7,;-3.81,4.67,;-3.97,3.14,;-2.83,2.11,;-3.45,.71,;-3.13,-.8,;-4.47,-1.57,;-3.13,-2.34,;-5.24,-2.9,;-4.47,-4.24,;-3.13,-3.47,;-5.8,-5.01,;-3.7,-5.57,;-4.47,-6.91,;-5.8,-7.68,;-4.47,-8.45,;-5.61,-.54,;-4.99,.87,;-5.31,2.37,;-2.48,5.44,;-1.07,4.82,;-.91,3.29,;.17,5.72,;1.58,5.1,;1.74,3.57,;3.15,2.94,;4.4,3.84,;5.8,3.22,;4.23,5.38,;5.48,6.28,;2.83,6,;-2.8,6.95,;-1.77,8.1,)|
Cn1nc(C2CC3CC(O)(CC3C2)C(=O)NC2CC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-3.67,7.03,;-2.87,5.71,;-3.46,4.29,;-2.29,3.29,;-2.42,1.75,;-3.74,.95,;-3.38,-.55,;-3.98,-1.97,;-2.81,-2.97,;-1.48,-3.74,;-1.49,-2.17,;-1.85,-.67,;-1.25,.75,;-3.58,-4.3,;-2.81,-5.64,;-5.12,-4.21,;-5.97,-5.49,;-7.35,-6.18,;-6.07,-7.03,;-.98,4.09,;.44,3.49,;.64,1.96,;1.67,4.43,;3.09,3.83,;3.28,2.3,;4.7,1.71,;5.93,2.64,;7.35,2.05,;5.73,4.17,;6.96,5.1,;4.31,4.76,;-1.33,5.59,;-.33,6.75,)|
Cn1nc(C2CC3COC(=O)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc([C@@H]2CC3COC(=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@@H]2CC3COC(=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@H]2CC3COC(=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
COc1cccc(c1)C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
COc1cccc(c1)[C@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
COc1cccc(c1)[C@@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc(C2CCC(C2)c2ccccc2)c(C(=O)Nc2cc(F)c(F)c(Br)c2)c1N
Cn1nc(C2CCC(C2)c2ccccc2)c(C(=O)Nc2ccc(F)c(c2)C#N)c1N
Cn1nc(C2CCC(C2)c2ccc(F)cc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CC3CC(O)(CSCCO)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-2.88,6.72,;-2.11,5.38,;-2.73,3.98,;-1.59,2.95,;-1.75,1.41,;-.61,.38,;-1.23,-1.02,;-.91,-2.53,;-2.25,-3.3,;-1.48,-4.63,;-3.15,-4.55,;-4.68,-4.39,;-5.59,-5.63,;-7.12,-5.47,;-8.02,-6.72,;-3.39,-2.27,;-2.76,-.86,;-3.08,.64,;-.26,3.72,;1.15,3.09,;1.31,1.56,;2.4,3.99,;3.8,3.37,;3.96,1.84,;5.37,1.21,;6.62,2.11,;8.02,1.49,;6.46,3.65,;7.7,4.55,;5.05,4.27,;-.58,5.22,;.45,6.37,)|
Cn1nc(C2CC3CC(O)(CSCCN4CCOCC4)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.19,7.99,;-4.42,6.66,;-5.05,5.25,;-3.91,4.22,;-4.07,2.69,;-2.92,1.66,;-3.55,.25,;-3.23,-1.26,;-4.56,-2.03,;-3.79,-3.36,;-5.33,-3.36,;-4.56,-4.69,;-3.03,-4.85,;-2.41,-6.26,;-.87,-6.42,;-.25,-7.83,;1.28,-7.99,;2.19,-6.74,;1.56,-5.34,;.03,-5.18,;-5.71,-1,;-5.08,.41,;-5.4,1.92,;-2.57,4.99,;-1.17,4.36,;-1.01,2.83,;.08,5.27,;1.49,4.64,;1.65,3.11,;3.05,2.48,;4.3,3.39,;5.71,2.76,;4.14,4.92,;5.39,5.83,;2.73,5.55,;-2.89,6.5,;-1.86,7.64,)|
COC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-4.02,-6.28,;-5.16,-5.25,;-4.84,-3.75,;-5.87,-2.6,;-5.1,-1.27,;-5.26,.26,;-3.86,.89,;-2.83,-.25,;-3.6,-1.59,;-3.44,-3.12,;-3.54,2.4,;-4.57,3.54,;-3.8,4.88,;-4.42,6.28,;-2.29,4.56,;-1.15,5.59,;-2.13,3.02,;-.8,2.25,;-.8,.71,;.54,3.02,;1.87,2.25,;1.87,.71,;3.21,-.06,;4.54,.71,;5.87,-.06,;4.54,2.25,;5.87,3.02,;3.21,3.02,)|
Nc1[nH]nc(C2CC3CC(=O)CC3C2)c1C(=O)Nc1ccc(F)c(Cl)c1
CC(=O)NC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-4.33,-7.04,;-4.01,-5.53,;-2.55,-5.05,;-5.16,-4.5,;-4.84,-2.99,;-5.87,-1.85,;-5.1,-.52,;-5.27,1.02,;-3.86,1.64,;-2.83,.5,;-3.6,-.83,;-3.43,-2.36,;-3.54,3.15,;-4.57,4.29,;-3.81,5.63,;-4.43,7.04,;-2.3,5.31,;-1.16,6.34,;-2.14,3.78,;-.8,3.01,;-.8,1.47,;.53,3.78,;1.87,3.02,;1.87,1.48,;3.2,.71,;4.54,1.48,;5.87,.71,;4.53,3.02,;5.87,3.79,;3.2,3.79,)|
Cn1nc(C2CC3CC4(CC3C2)OCCO4)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CCC(C2)c2ccc(OC(F)(F)F)cc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
CC(=O)Nc1ccc(cc1)C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
CC(C)Oc1ccc(cc1)C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
COCCOc1ccc(cc1)C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
Cn1nc(C2CC3CC(CC3C2)C#N)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,4.75,;-4.8,3.84,;-4.8,2.3,;-3.33,1.83,;-2.86,.36,;-3.76,-.88,;-2.86,-2.13,;-2.86,-3.67,;-1.39,-4.14,;-.49,-2.9,;-1.39,-1.65,;-1.39,-.11,;-.92,-5.61,;-.44,-7.07,;-2.43,3.07,;-.89,3.07,;-.12,1.74,;-.12,4.41,;1.42,4.41,;2.19,3.07,;3.73,3.07,;4.5,4.41,;6.04,4.41,;3.73,5.74,;4.5,7.07,;2.19,5.74,;-3.33,4.32,;-2.86,5.78,)|
[#6]-n1nc(-[#6@H]-2-[#6]-[#6]-3-[#6]\[#6](-[#6]-[#6@@H]-3-[#6]-2)=[#7]\[#8])c(-[#6](=O)-[#7]-c2ccc(F)c(Cl)c2)c1-[#7] |r|
Cn1nc(C2CC3CC(C)(O)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.03,3.22,;-4.69,2.45,;-4.53,.91,;-3.03,.59,;-2.4,-.81,;-.89,-1.13,;-.73,-2.67,;.3,-3.81,;-.47,-5.14,;-.87,-6.63,;.62,-6.23,;-1.98,-4.82,;-2.14,-3.29,;-3.17,-2.15,;-2.26,1.93,;-.73,2.09,;.18,.84,;-.1,3.49,;1.43,3.66,;2.34,2.41,;3.87,2.57,;4.5,3.98,;6.03,4.14,;3.59,5.22,;4.22,6.63,;2.06,5.06,;-3.29,3.07,;-2.97,4.58,)|
Cn1nc(C2CC3CC(CC3C2)NS(C)(=O)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-3.47,6.55,;-2.84,5.14,;-3.61,3.81,;-2.58,2.66,;-2.91,1.16,;-4.31,.53,;-4.15,-1,;-4.92,-2.33,;-3.89,-3.48,;-2.49,-2.85,;-2.65,-1.32,;-1.88,.01,;-4.22,-4.98,;-5.68,-5.46,;-6.82,-4.43,;-6.77,-6.55,;-4.59,-6.55,;-1.18,3.29,;.16,2.52,;.15,.98,;1.49,3.29,;2.82,2.52,;2.82,.98,;4.16,.2,;5.49,.97,;6.82,.2,;5.49,2.51,;6.82,3.28,;4.16,3.28,;-1.34,4.82,;-.19,5.85,)|
Cn1cc(cn1)C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-6.31,-7.47,;-5.26,-6.34,;-5.56,-4.83,;-4.22,-4.08,;-3.09,-5.13,;-3.73,-6.53,;-4.03,-2.55,;-5.16,-1.51,;-4.51,-.11,;-4.81,1.4,;-3.46,2.15,;-2.34,1.1,;-2.98,-.29,;-2.69,-1.8,;-3.28,3.68,;-4.41,4.73,;-3.76,6.13,;-4.51,7.47,;-2.23,5.94,;-1.18,7.07,;-1.93,4.43,;-.54,3.78,;-.4,2.25,;.72,4.67,;2.12,4.02,;2.26,2.49,;3.65,1.84,;4.91,2.73,;6.31,2.08,;4.78,4.26,;6.04,5.15,;3.38,4.91,)|
Cn1cc(cn1)-c1ccc(cc1)[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc(C2CC3CC(CC3C2)n2cccn2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.02,6.99,;-4.25,5.66,;-4.88,4.25,;-3.73,3.22,;-3.89,1.69,;-5.23,.92,;-4.91,-.59,;-5.53,-1.99,;-4.39,-3.02,;-3.05,-2.25,;-3.37,-.75,;-2.75,.66,;-4.55,-4.56,;-5.88,-5.33,;-5.56,-6.83,;-4.03,-6.99,;-3.4,-5.59,;-2.4,3.99,;-.99,3.37,;-.83,1.83,;.25,4.27,;1.66,3.64,;1.82,2.11,;3.23,1.49,;4.48,2.39,;5.88,1.76,;4.31,3.92,;5.56,4.83,;2.91,4.55,;-2.72,5.5,;-1.69,6.64,)|
Cn1nc(C2CC3CC(O)(CC3C2)C2CC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.03,3.96,;-4.69,3.19,;-4.53,1.66,;-3.03,1.34,;-2.4,-.07,;-.89,-.39,;-.73,-1.92,;.3,-3.07,;-.47,-4.4,;1.07,-4.4,;-1.98,-4.08,;-2.14,-2.55,;-3.17,-1.4,;-.87,-5.89,;-1.96,-6.98,;-.47,-7.37,;-2.26,2.67,;-.73,2.83,;.18,1.59,;-.1,4.24,;1.43,4.4,;2.34,3.15,;3.87,3.31,;4.5,4.72,;6.03,4.88,;3.59,5.97,;4.22,7.37,;2.06,5.81,;-3.29,3.82,;-2.97,5.32,)|
Cn1nc(C2CC3CC(CC(N)=O)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,4.92,;-4.8,4.01,;-4.8,2.47,;-3.33,1.99,;-2.86,.53,;-3.77,-.72,;-2.86,-1.96,;-2.86,-3.5,;-1.4,-3.98,;-.93,-5.45,;.58,-5.77,;1.61,-4.62,;1.06,-7.23,;-.49,-2.74,;-1.4,-1.49,;-1.4,.05,;-2.43,3.24,;-.89,3.24,;-.12,1.9,;-.12,4.57,;1.42,4.57,;2.19,3.23,;3.73,3.23,;4.5,4.57,;6.04,4.56,;3.73,5.9,;4.51,7.23,;2.19,5.9,;-3.33,4.48,;-2.86,5.95,)|
CCS(=O)(=O)C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-3.45,-6.5,;-1.95,-6.82,;-.92,-5.68,;.57,-5.28,;-.15,-7.01,;-1.39,-4.21,;-.49,-2.96,;-1.39,-1.72,;-1.39,-.18,;-2.86,.3,;-3.76,-.95,;-2.86,-2.19,;-2.86,-3.73,;-3.33,1.76,;-4.8,2.24,;-4.8,3.78,;-6.04,4.68,;-3.33,4.25,;-2.86,5.72,;-2.43,3.01,;-.89,3.01,;-.12,1.67,;-.12,4.34,;1.42,4.34,;2.19,3.01,;3.73,3.01,;4.5,4.34,;6.04,4.34,;3.73,5.68,;4.5,7.01,;2.19,5.68,)|
Cn1nc(C2CC3CC(CC3C2)N2CCCS2(=O)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.09,7.01,;-3.46,5.6,;-4.23,4.27,;-3.2,3.12,;-3.51,1.62,;-4.92,.99,;-4.76,-.54,;-5.52,-1.88,;-4.49,-3.02,;-3.09,-2.39,;-3.25,-.86,;-2.48,.47,;-4.81,-4.53,;-6.22,-5.16,;-6.05,-6.69,;-4.55,-7.01,;-3.78,-5.67,;-2.69,-6.76,;-2.69,-4.58,;-1.79,3.75,;-.45,2.98,;-.45,1.44,;.88,3.75,;2.21,2.99,;2.21,1.45,;3.55,.68,;4.88,1.45,;6.22,.68,;4.88,2.99,;6.21,3.76,;3.54,3.76,;-1.95,5.28,;-.81,6.31,)|
CN(C)C(=O)CC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(1.14,-3.16,;1.61,-4.62,;3.12,-4.95,;.58,-5.77,;1.05,-7.23,;-.93,-5.45,;-1.4,-3.98,;-2.87,-3.5,;-2.86,-1.96,;-3.77,-.72,;-2.86,.53,;-1.4,.05,;-1.4,-1.49,;-.5,-2.74,;-3.34,1.99,;-4.8,2.47,;-4.8,4.01,;-6.04,4.92,;-3.33,4.49,;-2.86,5.95,;-2.43,3.24,;-.89,3.24,;-.12,1.9,;-.12,4.57,;1.42,4.57,;2.19,3.23,;3.73,3.23,;4.5,4.56,;6.04,4.56,;3.73,5.9,;4.51,7.23,;2.19,5.9,)|
Cn1nc(C2CC3CC(CCO)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,4.18,;-4.8,3.27,;-4.8,1.73,;-3.33,1.26,;-2.86,-.21,;-3.76,-1.46,;-2.86,-2.7,;-2.86,-4.24,;-1.39,-4.72,;-.92,-6.18,;.59,-6.5,;1.62,-5.36,;-.49,-3.47,;-1.39,-2.23,;-1.39,-.69,;-2.43,2.5,;-.89,2.5,;-.12,1.17,;-.12,3.83,;1.42,3.83,;2.19,2.5,;3.73,2.5,;4.5,3.83,;6.04,3.83,;3.73,5.17,;4.5,6.5,;2.19,5.17,;-3.33,3.75,;-2.86,5.21,)|
CCS(=O)C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-2.28,-7.05,;-.75,-7.21,;.15,-5.97,;1.69,-6.13,;-.47,-4.56,;.3,-3.23,;-.73,-2.08,;-.89,-.55,;-2.4,-.23,;-3.17,-1.56,;-2.14,-2.71,;-1.98,-4.24,;-3.03,1.18,;-4.53,1.5,;-4.69,3.03,;-6.03,3.8,;-3.29,3.65,;-2.97,5.16,;-2.26,2.51,;-.73,2.67,;.18,1.42,;-.1,4.08,;1.43,4.24,;2.34,2.99,;3.87,3.15,;4.5,4.56,;6.03,4.72,;3.59,5.81,;4.22,7.21,;2.06,5.65,)|
[#6]-n1nc(-[#6@@H]-2-[#6]-[#6]-3-[#6]\[#6](-[#6]-[#6@@H]-3-[#6]-2)=[#7]\[#8])c(-[#6](=O)-[#7]-c2ccc(F)c(Cl)c2)c1-[#7] |r|
Cn1nc(C2CC3CC(CC3C2)S(C)(=O)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,4.69,;-4.8,3.78,;-4.8,2.24,;-3.34,1.77,;-2.86,.3,;-1.4,-.18,;-1.4,-1.72,;-.49,-2.96,;-1.4,-4.21,;-2.87,-3.73,;-2.86,-2.19,;-3.77,-.94,;-.93,-5.67,;-1.96,-6.82,;-.16,-7.01,;.56,-5.27,;-2.43,3.01,;-.89,3.01,;-.12,1.68,;-.12,4.34,;1.42,4.34,;2.19,3.01,;3.73,3.01,;4.5,4.34,;6.04,4.34,;3.73,5.67,;4.51,7.01,;2.19,5.67,;-3.33,4.26,;-2.86,5.72,)|
Cn1nc(C2CC3CC(CC3C2)N2CCOC2=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.07,7.01,;-3.44,5.6,;-4.22,4.27,;-3.19,3.12,;-3.51,1.61,;-4.91,.99,;-4.75,-.54,;-5.52,-1.88,;-4.5,-3.02,;-3.09,-2.4,;-3.25,-.86,;-2.48,.47,;-4.82,-4.53,;-6.22,-5.15,;-6.06,-6.68,;-4.56,-7.01,;-3.79,-5.67,;-2.26,-5.51,;-1.78,3.75,;-.45,2.97,;-.45,1.43,;.89,3.74,;2.22,2.97,;2.22,1.43,;3.55,.66,;4.89,1.43,;6.22,.66,;4.89,2.97,;6.22,3.74,;3.56,3.74,;-1.94,5.28,;-.79,6.31,)|
Cn1nc(C2CC3CC(CC3C2)C(N)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.05,6.28,;-3.42,4.88,;-4.19,3.54,;-3.16,2.4,;-3.48,.89,;-4.89,.26,;-4.73,-1.27,;-5.5,-2.6,;-4.46,-3.75,;-3.06,-3.12,;-3.22,-1.59,;-2.45,-.25,;-4.79,-5.25,;-6.25,-5.73,;-3.64,-6.28,;-1.75,3.02,;-.42,2.25,;-.42,.71,;.92,3.02,;2.25,2.25,;2.25,.71,;3.58,-.06,;4.92,.71,;6.25,-.06,;4.92,2.25,;6.25,3.02,;3.58,3.02,;-1.91,4.56,;-.77,5.59,)|
CNC(=O)C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-6.41,-6.76,;-6.09,-5.25,;-4.63,-4.78,;-3.48,-5.81,;-4.3,-3.27,;-5.34,-2.13,;-4.57,-.79,;-4.73,.74,;-3.32,1.37,;-2.29,.22,;-3.06,-1.11,;-2.9,-2.64,;-3,2.87,;-4.03,4.02,;-3.26,5.35,;-3.89,6.76,;-1.75,5.03,;-.61,6.06,;-1.59,3.5,;-.26,2.73,;-.26,1.19,;1.08,3.5,;2.41,2.73,;2.41,1.19,;3.74,.42,;5.08,1.19,;6.41,.42,;5.08,2.73,;6.41,3.5,;3.74,3.5,)|
CCOC(=O)CC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-2.03,-9.78,;-2.5,-8.31,;-1.47,-7.17,;-1.95,-5.7,;-3.45,-5.38,;-.92,-4.56,;-1.39,-3.09,;-2.86,-2.62,;-2.86,-1.08,;-3.76,.17,;-2.86,1.42,;-1.39,.94,;-1.39,-.6,;-.49,-1.85,;-3.33,2.88,;-4.8,3.36,;-4.8,4.9,;-6.04,5.8,;-3.33,5.37,;-2.86,6.84,;-2.43,4.13,;-.89,4.13,;-.12,2.79,;-.12,5.46,;1.42,5.46,;2.19,4.13,;3.73,4.13,;4.5,5.46,;6.04,5.46,;3.73,6.79,;4.5,8.13,;2.19,6.79,)|
Cn1nc(C2CC3CC(CC3C2)S(C)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.93,4.15,;-4.69,3.25,;-4.69,1.71,;-3.22,1.23,;-2.75,-.23,;-3.65,-1.48,;-2.75,-2.72,;-2.75,-4.26,;-1.28,-4.74,;-.38,-3.49,;-1.28,-2.25,;-1.28,-.71,;-.8,-6.2,;-1.84,-7.35,;.7,-6.52,;-2.32,2.48,;-.78,2.66,;.14,1.42,;-.17,4.07,;1.36,4.25,;2.32,3.05,;3.85,3.28,;4.41,4.71,;5.93,4.94,;3.45,5.92,;4.01,7.35,;1.93,5.69,;-3.22,3.72,;-2.75,5.19,)|
Cn1nc(C2CC3CC(CC3C2)OC(C)(C)C)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,4.91,;-4.8,4,;-4.8,2.46,;-3.33,1.99,;-2.86,.52,;-3.76,-.72,;-2.86,-1.97,;-2.86,-3.51,;-1.39,-3.98,;-.49,-2.74,;-1.39,-1.49,;-1.39,.05,;-.92,-5.45,;.59,-5.77,;1.62,-4.63,;1.06,-7.23,;.12,-4.3,;-2.43,3.23,;-.89,3.23,;-.12,1.9,;-.12,4.57,;1.42,4.57,;2.19,3.23,;3.73,3.23,;4.5,4.57,;6.04,4.57,;3.73,5.9,;4.5,7.23,;2.19,5.9,;-3.33,4.48,;-2.86,5.94,)|
Cn1cc(cn1)-c1ccc(cc1)[C@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
CCSC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(1.39,-5.01,;.62,-6.34,;-.92,-6.34,;-1.39,-4.88,;-2.86,-4.4,;-2.86,-2.86,;-3.76,-1.62,;-2.86,-.37,;-1.39,-.85,;-1.39,-2.39,;-.49,-3.63,;-3.33,1.09,;-4.8,1.57,;-4.8,3.11,;-6.04,4.02,;-3.33,3.59,;-2.86,5.05,;-2.43,2.34,;-.89,2.34,;-.12,1.01,;-.12,3.67,;1.42,3.67,;2.19,2.34,;3.73,2.34,;4.5,3.67,;6.04,3.67,;3.73,5.01,;4.5,6.34,;2.19,5.01,)|
CSC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-1.96,-6.91,;-.93,-5.77,;-1.4,-4.3,;-.49,-3.06,;-1.4,-1.81,;-1.4,-.27,;-2.86,.21,;-3.77,-1.04,;-2.86,-2.28,;-2.87,-3.82,;-3.34,1.67,;-4.8,2.15,;-4.8,3.69,;-6.04,4.6,;-3.33,4.16,;-2.86,5.63,;-2.43,2.92,;-.89,2.92,;-.12,1.58,;-.12,4.25,;1.42,4.25,;2.19,2.91,;3.73,2.91,;4.5,4.24,;6.04,4.24,;3.73,5.58,;4.51,6.91,;2.19,5.58,)|
Cn1nc(C2CC3CC(CC3C2)C(O)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.05,6.28,;-3.42,4.88,;-4.19,3.54,;-3.16,2.4,;-3.48,.89,;-4.89,.26,;-4.73,-1.27,;-5.5,-2.6,;-4.46,-3.75,;-3.06,-3.12,;-3.22,-1.59,;-2.45,-.25,;-4.79,-5.25,;-6.25,-5.73,;-3.64,-6.28,;-1.75,3.02,;-.42,2.25,;-.42,.71,;.92,3.02,;2.25,2.25,;2.25,.71,;3.58,-.06,;4.92,.71,;6.25,-.06,;4.92,2.25,;6.25,3.02,;3.58,3.02,;-1.91,4.56,;-.77,5.59,)|
CC(C)S(=O)(=O)N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
CN(C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)S(C)(=O)=O |(-3.07,-6.02,;-4.22,-4.98,;-3.89,-3.48,;-4.92,-2.33,;-4.15,-1,;-4.31,.53,;-2.91,1.16,;-1.88,.01,;-2.65,-1.32,;-2.49,-2.85,;-2.58,2.66,;-3.61,3.81,;-2.84,5.14,;-3.47,6.55,;-1.34,4.82,;-.19,5.85,;-1.18,3.29,;.16,2.52,;.15,.98,;1.49,3.29,;2.82,2.52,;2.82,.98,;4.16,.2,;5.49,.97,;6.82,.2,;5.49,2.51,;6.82,3.28,;4.16,3.28,;-5.68,-5.46,;-6.82,-4.43,;-6.77,-6.55,;-4.59,-6.55,)|
COC(=O)N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
Cn1nc(C2CC3CC(CC3C2)N2CCOCC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-3.89,7.27,;-3.26,5.87,;-4.03,4.53,;-3,3.39,;-3.32,1.88,;-4.73,1.26,;-4.57,-.28,;-5.34,-1.61,;-4.3,-2.75,;-2.9,-2.13,;-3.06,-.6,;-2.29,.74,;-4.63,-4.26,;-6.09,-4.74,;-6.41,-6.24,;-5.27,-7.27,;-3.8,-6.8,;-3.48,-5.29,;-1.59,4.01,;-.26,3.24,;-.26,1.7,;1.08,4.01,;2.41,3.24,;2.41,1.7,;3.74,.93,;5.08,1.7,;6.41,.93,;5.08,3.24,;6.41,4.01,;3.74,4.01,;-1.75,5.55,;-.61,6.58,)|
Cn1nc(C2CC3CC(CC3C2)N2CCNC2=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.07,7.01,;-3.44,5.6,;-4.22,4.27,;-3.19,3.12,;-3.51,1.61,;-4.91,.99,;-4.75,-.54,;-5.52,-1.88,;-4.5,-3.02,;-3.09,-2.4,;-3.25,-.86,;-2.48,.47,;-4.82,-4.53,;-6.22,-5.15,;-6.06,-6.68,;-4.56,-7.01,;-3.79,-5.67,;-2.26,-5.51,;-1.78,3.75,;-.45,2.97,;-.45,1.43,;.89,3.74,;2.22,2.97,;2.22,1.43,;3.55,.66,;4.89,1.43,;6.22,.66,;4.89,2.97,;6.22,3.74,;3.56,3.74,;-1.94,5.28,;-.79,6.31,)|
Cn1nc(C2CC3CN(CC3C2)C(=O)N2CCCC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CC3CN(CC3C2)S(C)(=O)=O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CC3CC(CC3C2)OCC(F)(F)F)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.19,6.62,;-4.42,5.28,;-5.05,3.88,;-3.91,2.85,;-4.07,1.31,;-5.4,.54,;-5.08,-.96,;-5.71,-2.37,;-4.56,-3.4,;-3.23,-2.63,;-3.55,-1.12,;-2.92,.28,;-4.72,-4.93,;-6.13,-5.56,;-6.29,-7.09,;-6.45,-8.62,;-7.82,-6.93,;-4.76,-7.25,;-2.57,3.62,;-1.17,2.99,;-1.01,1.46,;.08,3.89,;1.49,3.27,;1.65,1.74,;3.05,1.11,;4.3,2.02,;5.71,1.39,;4.14,3.55,;5.39,4.45,;2.73,4.17,;-2.89,5.12,;-1.86,6.27,)|
Cn1cc(cn1)[C@@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
CC(=O)N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
Cn1nc(C2CC3CN(CC3C2)C(=O)OC(C)(C)C)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
COc1ccc(cc1)[C@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1cc(cn1)[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
CNC(=O)N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
CCOC(=O)C=C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(3.6,-5.52,;3.13,-4.05,;1.62,-3.73,;.59,-4.88,;1.07,-6.34,;-.92,-4.56,;-1.39,-3.09,;-2.86,-2.62,;-2.86,-1.08,;-3.76,.17,;-2.86,1.42,;-1.39,.94,;-1.39,-.6,;-.49,-1.85,;-3.33,2.88,;-4.8,3.36,;-4.8,4.9,;-6.04,5.8,;-3.33,5.37,;-2.86,6.84,;-2.43,4.13,;-.89,4.13,;-.12,2.79,;-.12,5.46,;1.42,5.46,;2.19,4.13,;3.73,4.13,;4.5,5.46,;6.04,5.46,;3.73,6.79,;4.5,8.13,;2.19,6.79,)|
CC(N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)C(F)(F)F
COc1ccc(cc1)[C@@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc([C@@H]2CC3CNC(=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc(C2CC3CC(CC3C2)NS(=O)(=O)C(F)(F)F)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-7.73,4.02,;-6.48,3.11,;-5.02,3.59,;-4.11,2.34,;-2.57,2.34,;-1.67,1.1,;-.2,1.57,;1.26,1.1,;2.17,2.34,;1.26,3.59,;-.2,3.11,;-1.67,3.59,;3.71,2.34,;4.48,3.68,;5.81,2.91,;3.14,4.45,;5.25,5.01,;6.02,6.35,;6.58,4.24,;3.91,5.78,;-5.02,1.1,;-4.54,-.37,;-3.03,-.69,;-5.57,-1.51,;-5.09,-2.97,;-3.59,-3.3,;-3.11,-4.76,;-4.14,-5.9,;-3.67,-7.37,;-5.65,-5.58,;-6.68,-6.73,;-6.13,-4.12,;-6.48,1.57,;-7.73,.67,)|
Cn1nc(C2CC3CNC(=O)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CC3CSCC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CC3CC(CC3C2)N2CCCC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.07,7.01,;-3.45,5.6,;-4.22,4.27,;-3.19,3.12,;-3.51,1.61,;-4.92,.99,;-4.75,-.54,;-5.52,-1.88,;-4.49,-3.02,;-3.09,-2.4,;-3.25,-.86,;-2.48,.47,;-4.81,-4.53,;-6.22,-5.15,;-6.06,-6.69,;-4.55,-7.01,;-3.78,-5.67,;-1.78,3.75,;-.45,2.98,;-.45,1.44,;.89,3.75,;2.22,2.98,;2.22,1.44,;3.55,.67,;4.89,1.44,;6.22,.67,;4.89,2.98,;6.22,3.75,;3.55,3.75,;-1.94,5.28,;-.8,6.31,)|
Cn1nc([C@@H]2CC3CC(O)(CS(C)(=O)=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,16.17,(-3.83,-5.39,;-3.2,-6.79,;-3.97,-8.13,;-2.94,-9.27,;-3.25,-10.78,;-4.66,-11.41,;-4.5,-12.94,;-5.27,-14.27,;-4.23,-15.42,;-3.36,-16.68,;-4.87,-16.82,;-3.97,-18.07,;-2.72,-17.17,;-3.07,-19.32,;-5.22,-18.97,;-2.83,-14.79,;-2.99,-13.26,;-2.22,-11.92,;-1.53,-8.64,;-.2,-9.41,;-.19,-10.95,;1.14,-8.64,;2.47,-9.41,;2.47,-10.95,;3.81,-11.72,;5.14,-10.94,;6.48,-11.71,;5.14,-9.4,;6.47,-8.63,;3.8,-8.64,;-1.69,-7.11,;-.55,-6.08,)|
Cn1nc([C@@H]2CC3CC(O)(CS(C)(=O)=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:16.17,(-3.86,7.05,;-3.23,5.64,;-4,4.31,;-2.97,3.16,;-3.29,1.66,;-4.69,1.03,;-4.53,-.5,;-5.3,-1.84,;-4.27,-2.98,;-3.39,-4.25,;-4.9,-4.39,;-4,-5.64,;-2.75,-4.74,;-3.1,-6.89,;-5.25,-6.54,;-2.86,-2.35,;-3.02,-.82,;-2.25,.51,;-1.56,3.79,;-.23,3.02,;-.23,1.48,;1.1,3.79,;2.44,3.03,;2.44,1.49,;3.78,.72,;5.11,1.49,;6.44,.72,;5.11,3.03,;6.44,3.8,;3.77,3.8,;-1.73,5.32,;-.58,6.35,)|
Cn1cc(cn1)[C@H]1CC[C@@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc(C2CC3CC(N)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.42,5.77,;-3.79,4.36,;-4.56,3.03,;-3.53,1.88,;-3.86,.37,;-5.26,-.25,;-5.1,-1.78,;-5.87,-3.12,;-4.84,-4.26,;-5.17,-5.77,;-3.44,-3.64,;-3.6,-2.1,;-2.83,-.77,;-2.13,2.51,;-.79,1.74,;-.8,.2,;.54,2.5,;1.87,1.73,;1.87,.19,;3.2,-.58,;4.54,.19,;5.87,-.58,;4.54,1.73,;5.87,2.5,;3.21,2.5,;-2.29,4.04,;-1.14,5.07,)|
Cn1cc(cn1)[C@@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc(C2CC3CC(CC3C2)N2CCC2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,5.05,;-4.8,4.15,;-4.8,2.61,;-3.33,2.13,;-2.86,.67,;-3.76,-.58,;-2.86,-1.83,;-2.86,-3.37,;-1.39,-3.84,;-.49,-2.6,;-1.39,-1.35,;-1.39,.19,;-.92,-5.31,;-1.62,-6.68,;-.24,-7.38,;.46,-6.01,;-2.43,3.38,;-.89,3.38,;-.12,2.04,;-.12,4.71,;1.42,4.71,;2.19,3.38,;3.73,3.38,;4.5,4.71,;6.04,4.71,;3.73,6.04,;4.5,7.38,;2.19,6.04,;-3.33,4.62,;-2.86,6.09,)|
CNC1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-4.02,-6.28,;-5.17,-5.25,;-4.84,-3.74,;-5.87,-2.6,;-5.1,-1.27,;-5.26,.27,;-3.86,.89,;-2.83,-.25,;-3.6,-1.59,;-3.44,-3.12,;-3.53,2.4,;-4.56,3.54,;-3.79,4.87,;-4.42,6.28,;-2.29,4.55,;-1.14,5.58,;-2.13,3.02,;-.79,2.25,;-.8,.71,;.54,3.02,;1.87,2.25,;1.87,.71,;3.2,-.06,;4.54,.71,;5.87,-.06,;4.54,2.25,;5.87,3.02,;3.21,3.02,)|
Cn1nc([C@@H]2CC3CNC(=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc(C2CC3CC(CC3C2)NCCO)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-3.89,7.27,;-3.26,5.87,;-4.03,4.53,;-3,3.39,;-3.32,1.88,;-4.73,1.26,;-4.57,-.28,;-5.34,-1.61,;-4.3,-2.75,;-2.9,-2.13,;-3.06,-.6,;-2.29,.74,;-4.63,-4.26,;-6.09,-4.74,;-6.41,-6.24,;-5.27,-7.27,;-1.59,4.01,;-.26,3.24,;-.26,1.7,;1.08,4.01,;2.41,3.24,;2.41,1.7,;3.74,.93,;5.08,1.7,;6.41,.93,;5.08,3.24,;6.41,4.01,;3.74,4.01,;-1.75,5.55,;-.61,6.58,)|
CCN(CC)C1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(1.62,-4.95,;.59,-6.09,;-.92,-5.77,;-1.95,-6.91,;-3.45,-6.59,;-1.39,-4.31,;-2.86,-3.83,;-2.86,-2.29,;-3.76,-1.04,;-2.86,.2,;-1.39,-.27,;-1.39,-1.81,;-.49,-3.06,;-3.33,1.67,;-4.8,2.14,;-4.8,3.68,;-6.04,4.59,;-3.33,4.16,;-2.86,5.62,;-2.43,2.91,;-.89,2.91,;-.12,1.58,;-.12,4.25,;1.42,4.25,;2.19,2.91,;3.73,2.91,;4.5,4.25,;6.04,4.25,;3.73,5.58,;4.5,6.91,;2.19,5.58,)|
CN1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
CC(C)N1CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1
Cn1nc(C2CC3CNCC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc([C@@H]2CC3CS(=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc([C@@H]2CC3CS(=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
Cn1nc(C2CC3CC(O)(CC(O)=O)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.08,6.7,;-4.33,5.35,;-4.98,3.96,;-3.85,2.91,;-4.04,1.38,;-5.38,.63,;-5.09,-.88,;-5.74,-2.28,;-4.61,-3.33,;-5.7,-4.41,;-4.24,-4.82,;-5.35,-5.89,;-6.83,-5.46,;-4.99,-7.38,;-3.26,-2.58,;-3.56,-1.07,;-2.91,.33,;-2.51,3.66,;-1.11,3.01,;-.97,1.47,;.15,3.89,;1.55,3.24,;1.68,1.71,;3.08,1.06,;4.34,1.95,;5.74,1.3,;4.2,3.48,;5.46,4.37,;2.81,4.13,;-2.8,5.17,;-1.75,6.3,)|
Cn1nc(C2CC3CC(CC3C2)N2CCNC(=O)C2)c(C(=O)Nc2ccc(F)c(c2)C#N)c1N |(-4.55,7.55,;-3.93,6.14,;-4.7,4.81,;-3.67,3.67,;-3.99,2.16,;-5.39,1.53,;-5.23,0,;-6,-1.33,;-4.97,-2.48,;-3.56,-1.85,;-3.73,-.32,;-2.96,1.01,;-5.29,-3.98,;-6.76,-4.46,;-7.08,-5.97,;-5.93,-7,;-4.47,-6.52,;-3.32,-7.55,;-4.15,-5.01,;-2.26,4.29,;-.93,3.52,;-.93,1.98,;.41,4.29,;1.74,3.52,;1.74,1.98,;3.08,1.21,;4.41,1.98,;5.74,1.21,;4.46,3.55,;3.08,4.29,;5.79,4.32,;7.12,5.09,;-2.42,5.82,;-1.28,6.85,)|
CCS(=O)(=O)CC1(O)CC2C[C@H](C[C@H]2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r,wU:13.12,11.16,(-.82,-6.21,;-2.3,-5.78,;-2.67,-4.29,;-4.16,-4.65,;-1.17,-3.92,;-3.04,-2.79,;-4.51,-2.36,;-4.12,-3.85,;-5.54,-1.22,;-4.77,.12,;-4.94,1.65,;-3.53,2.28,;-2.5,1.13,;-3.27,-.2,;-3.11,-1.73,;-3.21,3.78,;-4.24,4.93,;-3.47,6.26,;-4.1,7.67,;-1.96,5.94,;-.82,6.97,;-1.8,4.41,;-.47,3.64,;-.47,2.1,;.87,4.41,;2.2,3.64,;2.2,2.1,;3.53,1.33,;4.87,2.1,;6.2,1.33,;4.87,3.64,;6.2,4.41,;3.53,4.41,)|
CCS(=O)(=O)CC1(O)CC2C[C@H](C[C@@H]2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r,wU:11.16,wD:13.12,(-.82,-6.21,;-2.3,-5.78,;-2.67,-4.29,;-4.16,-4.65,;-1.17,-3.92,;-3.04,-2.79,;-4.51,-2.36,;-4.12,-3.85,;-5.54,-1.22,;-4.77,.12,;-4.94,1.65,;-3.53,2.28,;-2.5,1.13,;-3.27,-.2,;-3.11,-1.73,;-3.21,3.78,;-4.24,4.93,;-3.47,6.26,;-4.1,7.67,;-1.96,5.94,;-.82,6.97,;-1.8,4.41,;-.47,3.64,;-.47,2.1,;.87,4.41,;2.2,3.64,;2.2,2.1,;3.53,1.33,;4.87,2.1,;6.2,1.33,;4.87,3.64,;6.2,4.41,;3.53,4.41,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)C4CC4)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:18.20,4.3,(-4.02,7.85,;-3.39,6.45,;-4.16,5.11,;-3.13,3.97,;-3.45,2.46,;-4.86,1.84,;-4.7,.31,;-5.47,-1.03,;-4.44,-2.17,;-4.04,-3.66,;-5.34,-3.42,;-4.87,-4.88,;-3.33,-4.88,;-6.28,-5.51,;-4.39,-6.35,;-4.71,-7.85,;-3.25,-7.38,;-3.03,-1.55,;-3.19,-.01,;-2.42,1.32,;-1.73,4.6,;-.39,3.83,;-.39,2.29,;.94,4.6,;2.27,3.83,;2.27,2.29,;3.61,1.52,;4.94,2.29,;6.28,1.52,;4.94,3.83,;6.28,4.6,;3.61,4.6,;-1.89,6.13,;-.74,7.16,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)C4CC4)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:18.20,(-4.02,7.85,;-3.39,6.45,;-4.16,5.11,;-3.13,3.97,;-3.45,2.46,;-4.86,1.84,;-4.7,.31,;-5.47,-1.03,;-4.44,-2.17,;-4.04,-3.66,;-5.34,-3.42,;-4.87,-4.88,;-3.33,-4.88,;-6.28,-5.51,;-4.39,-6.35,;-4.71,-7.85,;-3.25,-7.38,;-3.03,-1.55,;-3.19,-.01,;-2.42,1.32,;-1.73,4.6,;-.39,3.83,;-.39,2.29,;.94,4.6,;2.27,3.83,;2.27,2.29,;3.61,1.52,;4.94,2.29,;6.28,1.52,;4.94,3.83,;6.28,4.6,;3.61,4.6,;-1.89,6.13,;-.74,7.16,)|
Cn1nc(C2CC3CC(O)(COC(F)F)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.08,7.24,;-4.33,5.9,;-4.98,4.5,;-3.85,3.45,;-4.04,1.92,;-5.38,1.18,;-5.09,-.34,;-5.74,-1.73,;-4.61,-2.78,;-3.12,-3.18,;-5.7,-3.87,;-5.3,-5.36,;-3.81,-5.76,;-3.41,-7.24,;-2.72,-4.67,;-3.26,-2.03,;-3.56,-.52,;-2.91,.88,;-2.51,4.2,;-1.11,3.55,;-.97,2.02,;.15,4.44,;1.55,3.79,;1.68,2.25,;3.08,1.61,;4.34,2.49,;5.74,1.84,;4.2,4.02,;5.46,4.91,;2.81,4.67,;-2.8,5.71,;-1.75,6.84,)|
Cn1nc(C2CC3CC(O)(COCC(F)(F)F)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5.19,8.11,;-4.42,6.77,;-5.05,5.36,;-3.91,4.33,;-4.07,2.8,;-2.92,1.77,;-3.55,.37,;-3.23,-1.14,;-4.56,-1.91,;-3.47,-3,;-5.33,-3.24,;-4.93,-4.73,;-6.02,-5.82,;-7.51,-5.42,;-9,-5.02,;-7.11,-3.93,;-7.91,-6.91,;-5.71,-.88,;-5.08,.53,;-5.4,2.03,;-2.57,5.1,;-1.17,4.48,;-1.01,2.95,;.08,5.38,;1.49,4.76,;1.65,3.23,;3.05,2.6,;4.3,3.5,;5.71,2.88,;4.14,5.04,;5.39,5.94,;2.73,5.66,;-2.89,6.61,;-1.86,7.76,)|
CCC1OCC2(CC3C[C@@H](C[C@H]3C2)c2nn(C)c(N)c2C(=O)Nc2ccc(F)c(Cl)c2)O1 |r,wU:11.10,wD:9.14,(-1.85,-6.99,;-3.39,-6.89,;-4.15,-5.55,;-5.68,-5.24,;-5.76,-3.78,;-4.58,-3.03,;-5.71,-1.98,;-5.06,-.59,;-5.36,.93,;-4.01,1.67,;-2.89,.63,;-3.53,-.77,;-3.24,-2.28,;-3.83,3.2,;-4.96,4.25,;-4.31,5.65,;-5.05,6.99,;-2.78,5.46,;-1.73,6.59,;-2.48,3.95,;-1.09,3.3,;-.95,1.77,;.18,4.19,;1.57,3.54,;1.71,2,;3.1,1.36,;4.37,2.24,;5.76,1.59,;4.23,3.78,;5.49,4.66,;2.83,4.42,;-3.62,-4.06,)|
CCC1OCC2(CC3C[C@@H](C[C@@H]3C2)c2nn(C)c(N)c2C(=O)Nc2ccc(F)c(Cl)c2)O1 |r,wD:9.14,11.10,(-1.85,-6.99,;-3.39,-6.89,;-4.15,-5.55,;-5.68,-5.24,;-5.76,-3.78,;-4.58,-3.03,;-5.71,-1.98,;-5.06,-.59,;-5.36,.93,;-4.01,1.67,;-2.89,.63,;-3.53,-.77,;-3.24,-2.28,;-3.83,3.2,;-4.96,4.25,;-4.31,5.65,;-5.05,6.99,;-2.78,5.46,;-1.73,6.59,;-2.48,3.95,;-1.09,3.3,;-.95,1.77,;.18,4.19,;1.57,3.54,;1.71,2,;3.1,1.36,;4.37,2.24,;5.76,1.59,;4.23,3.78,;5.49,4.66,;2.83,4.42,;-3.62,-4.06,)|
CCC1OC[C@]2(CC3C[C@@H](C[C@@H]3C2)c2nn(C)c(N)c2C(=O)Nc2ccc(F)c(Cl)c2)O1 |r,wD:9.14,11.10,5.34,(-1.85,-6.99,;-3.39,-6.89,;-4.15,-5.55,;-5.68,-5.24,;-5.76,-3.78,;-4.58,-3.03,;-5.71,-1.98,;-5.06,-.59,;-5.36,.93,;-4.01,1.67,;-2.89,.63,;-3.53,-.77,;-3.24,-2.28,;-3.83,3.2,;-4.96,4.25,;-4.31,5.65,;-5.05,6.99,;-2.78,5.46,;-1.73,6.59,;-2.48,3.95,;-1.09,3.3,;-.95,1.77,;.18,4.19,;1.57,3.54,;1.71,2,;3.1,1.36,;4.37,2.24,;5.76,1.59,;4.23,3.78,;5.49,4.66,;2.83,4.42,;-3.62,-4.06,)|
Cn1nc(C2CC3CC(O)(CC3C2)C(C)(C)O)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-4.65,6.34,;-3.88,5.01,;-4.5,3.6,;-3.36,2.57,;-3.51,1.04,;-4.85,.27,;-4.52,-1.24,;-5.15,-2.65,;-4,-3.67,;-2.67,-4.44,;-2.67,-2.9,;-2.99,-1.4,;-2.37,.01,;-4.77,-5.01,;-6.26,-5.21,;-5.86,-3.92,;-4,-6.34,;-2.02,3.34,;-.61,2.72,;-.45,1.19,;.63,3.63,;2.04,3,;2.2,1.47,;3.61,.85,;4.85,1.75,;6.26,1.13,;4.69,3.28,;5.93,4.19,;3.28,3.91,;-2.34,4.85,;-1.32,6,)|
CC(C)C1(O)CC2C[C@H](C[C@H]2C1O)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r|
Cn1nc([C@@H]2CC3CC(O)(CSCC(F)(F)F)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:18.19,4.3,(-5.19,7.74,;-4.42,6.4,;-5.05,5,;-3.91,3.97,;-4.07,2.44,;-5.4,1.67,;-5.08,.16,;-5.71,-1.25,;-4.56,-2.28,;-5.33,-3.61,;-3.79,-3.61,;-4.56,-4.95,;-6.1,-4.95,;-6.87,-6.28,;-7.64,-7.61,;-8.21,-5.51,;-5.54,-7.05,;-3.23,-1.51,;-3.55,-0,;-2.92,1.41,;-2.57,4.74,;-1.17,4.11,;-1.01,2.58,;.08,5.02,;1.49,4.39,;1.65,2.86,;3.05,2.23,;4.3,3.14,;5.71,2.51,;4.14,4.67,;5.39,5.57,;2.73,5.29,;-2.89,6.24,;-1.86,7.39,)|
Cn1nc([C@@H]2CC3CC(O)(CSCC(F)(F)F)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:18.19,(-5.19,7.74,;-4.42,6.4,;-5.05,5,;-3.91,3.97,;-4.07,2.44,;-5.4,1.67,;-5.08,.16,;-5.71,-1.25,;-4.56,-2.28,;-5.33,-3.61,;-3.79,-3.61,;-4.56,-4.95,;-6.1,-4.95,;-6.87,-6.28,;-7.64,-7.61,;-8.21,-5.51,;-5.54,-7.05,;-3.23,-1.51,;-3.55,-0,;-2.92,1.41,;-2.57,4.74,;-1.17,4.11,;-1.01,2.58,;.08,5.02,;1.49,4.39,;1.65,2.86,;3.05,2.23,;4.3,3.14,;5.71,2.51,;4.14,4.67,;5.39,5.57,;2.73,5.29,;-2.89,6.24,;-1.86,7.39,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)CC(F)(F)F)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,19.20,(-4.39,7.99,;-3.77,6.58,;-4.54,5.25,;-3.51,4.1,;-3.83,2.6,;-5.23,1.97,;-5.07,.44,;-5.84,-.89,;-4.81,-2.04,;-4.41,-3.53,;-5.9,-3.13,;-5.5,-4.62,;-3.96,-4.62,;-6.44,-5.84,;-5.85,-7.26,;-5.26,-8.68,;-7.27,-7.85,;-4.43,-6.67,;-3.41,-1.41,;-3.57,.12,;-2.8,1.45,;-2.1,4.73,;-.77,3.96,;-.77,2.42,;.57,4.73,;1.9,3.96,;1.9,2.42,;3.23,1.65,;4.57,2.42,;5.9,1.65,;4.57,3.96,;5.9,4.73,;3.23,4.73,;-2.26,6.26,;-1.12,7.29,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)CC(F)(F)F)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:19.20,(-4.39,7.99,;-3.77,6.58,;-4.54,5.25,;-3.51,4.1,;-3.83,2.6,;-5.23,1.97,;-5.07,.44,;-5.84,-.89,;-4.81,-2.04,;-4.41,-3.53,;-5.9,-3.13,;-5.5,-4.62,;-3.96,-4.62,;-6.44,-5.84,;-5.85,-7.26,;-5.26,-8.68,;-7.27,-7.85,;-4.43,-6.67,;-3.41,-1.41,;-3.57,.12,;-2.8,1.45,;-2.1,4.73,;-.77,3.96,;-.77,2.42,;.57,4.73,;1.9,3.96,;1.9,2.42,;3.23,1.65,;4.57,2.42,;5.9,1.65,;4.57,3.96,;5.9,4.73,;3.23,4.73,;-2.26,6.26,;-1.12,7.29,)|
Cn1nc([C@H]2CC3CC(O)(CS(=O)CC(F)(F)F)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:19.20,wD:4.3,(-4.39,7.99,;-3.77,6.58,;-4.54,5.25,;-3.51,4.1,;-3.83,2.6,;-5.23,1.97,;-5.07,.44,;-5.84,-.89,;-4.81,-2.04,;-4.41,-3.53,;-5.9,-3.13,;-5.5,-4.62,;-3.96,-4.62,;-6.44,-5.84,;-5.85,-7.26,;-5.26,-8.68,;-7.27,-7.85,;-4.43,-6.67,;-3.41,-1.41,;-3.57,.12,;-2.8,1.45,;-2.1,4.73,;-.77,3.96,;-.77,2.42,;.57,4.73,;1.9,3.96,;1.9,2.42,;3.23,1.65,;4.57,2.42,;5.9,1.65,;4.57,3.96,;5.9,4.73,;3.23,4.73,;-2.26,6.26,;-1.12,7.29,)|
Cn1nc([C@H]2CC3CC(O)(CS(=O)CC(F)(F)F)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wD:4.3,19.20,(-4.39,7.99,;-3.77,6.58,;-4.54,5.25,;-3.51,4.1,;-3.83,2.6,;-5.23,1.97,;-5.07,.44,;-5.84,-.89,;-4.81,-2.04,;-4.41,-3.53,;-5.9,-3.13,;-5.5,-4.62,;-3.96,-4.62,;-6.44,-5.84,;-5.85,-7.26,;-5.26,-8.68,;-7.27,-7.85,;-4.43,-6.67,;-3.41,-1.41,;-3.57,.12,;-2.8,1.45,;-2.1,4.73,;-.77,3.96,;-.77,2.42,;.57,4.73,;1.9,3.96,;1.9,2.42,;3.23,1.65,;4.57,2.42,;5.9,1.65,;4.57,3.96,;5.9,4.73,;3.23,4.73,;-2.26,6.26,;-1.12,7.29,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)C(C)(C)C)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:19.20,4.3,(-3.1,6.31,;-2.33,4.98,;-2.96,3.57,;-1.81,2.54,;-1.97,1.01,;-3.31,.24,;-2.99,-1.26,;-3.61,-2.67,;-2.47,-3.7,;-1.7,-5.03,;-3.24,-5.03,;-4.76,-4.79,;-4.52,-3.27,;-5,-6.31,;-6.28,-4.55,;-7.25,-5.75,;-6.83,-3.12,;-7.8,-4.31,;-1.13,-2.93,;-1.46,-1.42,;-.83,-.02,;-.48,3.31,;.93,2.69,;1.09,1.16,;2.17,3.59,;3.58,2.97,;3.74,1.43,;5.15,.81,;6.39,1.71,;7.8,1.09,;6.23,3.25,;7.48,4.15,;4.83,3.87,;-.8,4.82,;.23,5.96,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)C(C)(C)C)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:19.20,(-3.1,6.31,;-2.33,4.98,;-2.96,3.57,;-1.81,2.54,;-1.97,1.01,;-3.31,.24,;-2.99,-1.26,;-3.61,-2.67,;-2.47,-3.7,;-1.7,-5.03,;-3.24,-5.03,;-4.76,-4.79,;-4.52,-3.27,;-5,-6.31,;-6.28,-4.55,;-7.25,-5.75,;-6.83,-3.12,;-7.8,-4.31,;-1.13,-2.93,;-1.46,-1.42,;-.83,-.02,;-.48,3.31,;.93,2.69,;1.09,1.16,;2.17,3.59,;3.58,2.97,;3.74,1.43,;5.15,.81,;6.39,1.71,;7.8,1.09,;6.23,3.25,;7.48,4.15,;4.83,3.87,;-.8,4.82,;.23,5.96,)|
Cn1nc([C@@H]2CC3CC(O)(CSC(C)(C)C)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:17.18,4.3,(-3.33,6.88,;-2.56,5.54,;-3.19,4.14,;-2.04,3.11,;-2.2,1.57,;-3.54,.8,;-3.22,-.7,;-3.84,-2.11,;-2.7,-3.14,;-1.93,-4.47,;-3.6,-4.39,;-5.14,-4.22,;-6.04,-5.47,;-7.57,-5.31,;-5.41,-6.88,;-6.95,-6.72,;-1.36,-2.37,;-1.68,-.86,;-1.06,.54,;-.71,3.88,;.7,3.25,;.86,1.72,;1.94,4.15,;3.35,3.53,;3.51,2,;4.92,1.37,;6.17,2.28,;7.57,1.65,;6,3.81,;7.25,4.71,;4.6,4.43,;-1.03,5.38,;0,6.53,)|
Cn1nc([C@@H]2CC3CC(O)(CSC(C)(C)C)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:17.18,(-3.33,6.88,;-2.56,5.54,;-3.19,4.14,;-2.04,3.11,;-2.2,1.57,;-3.54,.8,;-3.22,-.7,;-3.84,-2.11,;-2.7,-3.14,;-1.93,-4.47,;-3.6,-4.39,;-5.14,-4.22,;-6.04,-5.47,;-7.57,-5.31,;-5.41,-6.88,;-6.95,-6.72,;-1.36,-2.37,;-1.68,-.86,;-1.06,.54,;-.71,3.88,;.7,3.25,;.86,1.72,;1.94,4.15,;3.35,3.53,;3.51,2,;4.92,1.37,;6.17,2.28,;7.57,1.65,;6,3.81,;7.25,4.71,;4.6,4.43,;-1.03,5.38,;0,6.53,)|
CN(C)S(=O)(=O)CC1(O)CC2CC(CC2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(-4.47,-7.68,;-3.7,-6.34,;-2.21,-6.62,;-4.47,-5.01,;-3.13,-4.24,;-5.8,-5.78,;-5.24,-3.67,;-4.47,-2.34,;-3.13,-3.11,;-3.13,-1.57,;-3.45,-.06,;-2.83,1.34,;-3.97,2.37,;-5.31,1.6,;-4.99,.1,;-5.61,-1.31,;-3.81,3.9,;-4.96,4.93,;-4.33,6.34,;-5.1,7.68,;-2.8,6.18,;-1.77,7.33,;-2.48,4.67,;-1.07,4.05,;-.91,2.52,;.17,4.95,;1.58,4.33,;1.74,2.8,;3.15,2.17,;4.4,3.07,;5.8,2.45,;4.23,4.61,;5.48,5.51,;2.83,5.23,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)CCO)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:18.19,4.3,(-4.99,8.41,;-4.22,7.07,;-4.85,5.67,;-3.7,4.64,;-3.86,3.11,;-5.2,2.34,;-4.88,.83,;-5.5,-.58,;-4.36,-1.61,;-3.03,-2.38,;-5.13,-2.94,;-4.5,-4.35,;-3.1,-3.72,;-5.91,-4.98,;-3.88,-5.76,;-4.78,-7,;-4.16,-8.41,;-3.03,-.84,;-3.35,.67,;-2.72,2.08,;-2.37,5.41,;-.96,4.78,;-.8,3.25,;.28,5.69,;1.69,5.06,;1.85,3.53,;3.26,2.9,;4.5,3.81,;5.91,3.18,;4.34,5.34,;5.59,6.24,;2.94,5.96,;-2.69,6.91,;-1.66,8.06,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)CCO)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:18.19,(-4.99,8.41,;-4.22,7.07,;-4.85,5.67,;-3.7,4.64,;-3.86,3.11,;-5.2,2.34,;-4.88,.83,;-5.5,-.58,;-4.36,-1.61,;-3.03,-2.38,;-5.13,-2.94,;-4.5,-4.35,;-3.1,-3.72,;-5.91,-4.98,;-3.88,-5.76,;-4.78,-7,;-4.16,-8.41,;-3.03,-.84,;-3.35,.67,;-2.72,2.08,;-2.37,5.41,;-.96,4.78,;-.8,3.25,;.28,5.69,;1.69,5.06,;1.85,3.53,;3.26,2.9,;4.5,3.81,;5.91,3.18,;4.34,5.34,;5.59,6.24,;2.94,5.96,;-2.69,6.91,;-1.66,8.06,)|
Cn1nc(C2CCC(C2)c2cccnc2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc([C@@H]2CC3CC(O)(CC(O)=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,15.16,(-5.08,6.7,;-4.33,5.35,;-4.98,3.96,;-3.85,2.91,;-4.04,1.38,;-5.38,.63,;-5.09,-.88,;-5.74,-2.28,;-4.61,-3.33,;-5.7,-4.41,;-4.24,-4.82,;-5.35,-5.89,;-6.83,-5.46,;-4.99,-7.38,;-3.26,-2.58,;-3.56,-1.07,;-2.91,.33,;-2.51,3.66,;-1.11,3.01,;-.97,1.47,;.15,3.89,;1.55,3.24,;1.68,1.71,;3.08,1.06,;4.34,1.95,;5.74,1.3,;4.2,3.48,;5.46,4.37,;2.81,4.13,;-2.8,5.17,;-1.75,6.3,)|
Cn1nc([C@@H]2CC3CC(O)(CC(O)=O)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:15.16,(-5.08,6.7,;-4.33,5.35,;-4.98,3.96,;-3.85,2.91,;-4.04,1.38,;-5.38,.63,;-5.09,-.88,;-5.74,-2.28,;-4.61,-3.33,;-5.7,-4.41,;-4.24,-4.82,;-5.35,-5.89,;-6.83,-5.46,;-4.99,-7.38,;-3.26,-2.58,;-3.56,-1.07,;-2.91,.33,;-2.51,3.66,;-1.11,3.01,;-.97,1.47,;.15,3.89,;1.55,3.24,;1.68,1.71,;3.08,1.06,;4.34,1.95,;5.74,1.3,;4.2,3.48,;5.46,4.37,;2.81,4.13,;-2.8,5.17,;-1.75,6.3,)|
Cn1nc([C@@H]2CC3CC(O)(CSCCO)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:16.17,4.3,(-2.88,6.72,;-2.11,5.38,;-2.73,3.98,;-1.59,2.95,;-1.75,1.41,;-3.08,.64,;-2.76,-.86,;-3.39,-2.27,;-2.25,-3.3,;-1.48,-4.63,;-3.15,-4.55,;-4.68,-4.38,;-5.59,-5.63,;-7.12,-5.47,;-8.02,-6.72,;-.91,-2.53,;-1.23,-1.02,;-.61,.38,;-.26,3.71,;1.15,3.09,;1.31,1.56,;2.4,3.99,;3.8,3.37,;3.96,1.84,;5.37,1.21,;6.62,2.11,;8.02,1.49,;6.46,3.65,;7.7,4.55,;5.05,4.27,;-.58,5.22,;.45,6.37,)|
Cn1nc([C@@H]2CC3CC(O)(CSCCO)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:16.17,(-2.88,6.72,;-2.11,5.38,;-2.73,3.98,;-1.59,2.95,;-1.75,1.41,;-3.08,.64,;-2.76,-.86,;-3.39,-2.27,;-2.25,-3.3,;-1.48,-4.63,;-3.15,-4.55,;-4.68,-4.38,;-5.59,-5.63,;-7.12,-5.47,;-8.02,-6.72,;-.91,-2.53,;-1.23,-1.02,;-.61,.38,;-.26,3.71,;1.15,3.09,;1.31,1.56,;2.4,3.99,;3.8,3.37,;3.96,1.84,;5.37,1.21,;6.62,2.11,;8.02,1.49,;6.46,3.65,;7.7,4.55,;5.05,4.27,;-.58,5.22,;.45,6.37,)|
Cn1nc([C@@H]2CC3CC(O)(CSCCN4CCOCC4)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:21.23,4.3,(-5.19,7.99,;-4.42,6.66,;-5.05,5.25,;-3.91,4.22,;-4.07,2.69,;-5.4,1.92,;-5.08,.41,;-5.71,-1,;-4.56,-2.03,;-3.79,-3.36,;-5.33,-3.36,;-4.56,-4.69,;-3.03,-4.85,;-2.41,-6.26,;-.87,-6.42,;-.25,-7.83,;1.28,-7.99,;2.19,-6.74,;1.56,-5.34,;.03,-5.18,;-3.23,-1.26,;-3.55,.25,;-2.92,1.66,;-2.57,4.99,;-1.17,4.36,;-1.01,2.83,;.08,5.27,;1.49,4.64,;1.65,3.11,;3.05,2.48,;4.3,3.39,;5.71,2.76,;4.14,4.92,;5.39,5.83,;2.73,5.55,;-2.89,6.5,;-1.86,7.64,)|
Cn1nc([C@@H]2CC3CC(O)(CSCCN4CCOCC4)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:21.23,(-5.19,7.99,;-4.42,6.66,;-5.05,5.25,;-3.91,4.22,;-4.07,2.69,;-5.4,1.92,;-5.08,.41,;-5.71,-1,;-4.56,-2.03,;-3.79,-3.36,;-5.33,-3.36,;-4.56,-4.69,;-3.03,-4.85,;-2.41,-6.26,;-.87,-6.42,;-.25,-7.83,;1.28,-7.99,;2.19,-6.74,;1.56,-5.34,;.03,-5.18,;-3.23,-1.26,;-3.55,.25,;-2.92,1.66,;-2.57,4.99,;-1.17,4.36,;-1.01,2.83,;.08,5.27,;1.49,4.64,;1.65,3.11,;3.05,2.48,;4.3,3.39,;5.71,2.76,;4.14,4.92,;5.39,5.83,;2.73,5.55,;-2.89,6.5,;-1.86,7.64,)|
CCOC(=O)c1c(N)onc1C1CCC(C1)c1ccccc1
CS(=O)(=O)CC1(O)CC2CC(CC2C1)c1n[nH]c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |(.45,-5.44,;-.62,-6.55,;.5,-7.62,;-1.68,-7.66,;-1.73,-5.49,;-1.36,-3.99,;-.27,-5.08,;-2.86,-3.63,;-2.98,-2.1,;-3.98,-.92,;-3.17,.39,;-1.68,.03,;-1.56,-1.51,;-.56,-2.68,;-3.76,1.81,;-5.26,2.17,;-5.38,3.71,;-3.96,4.3,;-3.6,5.79,;-2.96,3.12,;-1.42,3.25,;-.55,1.98,;-.76,4.63,;.78,4.76,;1.65,3.49,;3.18,3.61,;3.85,5,;5.38,5.12,;2.97,6.27,;3.64,7.66,;1.44,6.15,)|
Cn1nc(C2CC3CC4(CNC(=O)C4)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-6.04,5.85,;-4.8,4.94,;-4.8,3.4,;-3.33,2.92,;-2.86,1.46,;-1.36,1.12,;-1.22,-.42,;-.2,-1.58,;-1,-2.9,;.53,-3.14,;.77,-4.66,;-.6,-5.36,;-.84,-6.88,;-1.69,-4.27,;-2.5,-2.56,;-2.63,-1.02,;-3.65,.14,;-2.43,4.17,;-.89,4.17,;-.12,2.84,;-.12,5.5,;1.42,5.5,;2.19,6.84,;3.73,6.84,;4.5,5.5,;6.04,5.5,;3.73,4.17,;4.5,2.84,;2.19,4.17,;-3.33,5.42,;-2.86,6.88,)|
CC(C)OCC1(O)CC2C[C@H](C[C@H]2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r,wU:10.15,12.11,(-7.59,-4.88,;-6.1,-5.28,;-5.7,-6.77,;-5.01,-4.19,;-3.53,-4.59,;-2.76,-3.26,;-1.99,-4.59,;-3.88,-2.21,;-3.23,-.81,;-3.53,.7,;-2.18,1.45,;-1.06,.4,;-1.71,-1,;-1.41,-2.51,;-2,2.98,;-3.13,4.03,;-2.48,5.42,;-3.23,6.77,;-.95,5.24,;.1,6.36,;-.65,3.73,;.74,3.08,;.88,1.54,;2,3.96,;3.4,3.31,;3.54,1.78,;4.93,1.13,;6.19,2.02,;7.59,1.37,;6.06,3.55,;7.32,4.43,;4.66,4.2,)|
CC(C)OCC1(O)CC2C[C@H](C[C@@H]2C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1 |r,wU:10.15,wD:12.11,(-7.59,-4.88,;-6.1,-5.28,;-5.7,-6.77,;-5.01,-4.19,;-3.53,-4.59,;-2.76,-3.26,;-1.99,-4.59,;-3.88,-2.21,;-3.23,-.81,;-3.53,.7,;-2.18,1.45,;-1.06,.4,;-1.71,-1,;-1.41,-2.51,;-2,2.98,;-3.13,4.03,;-2.48,5.42,;-3.23,6.77,;-.95,5.24,;.1,6.36,;-.65,3.73,;.74,3.08,;.88,1.54,;2,3.96,;3.4,3.31,;3.54,1.78,;4.93,1.13,;6.19,2.02,;7.59,1.37,;6.06,3.55,;7.32,4.43,;4.66,4.2,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)CCCN4CCCCC4)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:24.26,(-5,8.89,;-4.23,7.56,;-4.85,6.15,;-3.71,5.12,;-3.87,3.59,;-5.2,2.82,;-4.88,1.32,;-5.51,-.09,;-4.37,-1.12,;-3.03,-1.89,;-5.14,-2.46,;-4.37,-3.79,;-5.91,-3.79,;-5.14,-5.12,;-2.88,-4.19,;-2.48,-5.68,;-.99,-6.07,;-.59,-7.56,;.19,-8.89,;1.73,-8.89,;2.5,-7.56,;1.73,-6.23,;.19,-6.23,;-3.03,-.35,;-3.35,1.15,;-2.73,2.56,;-2.38,5.89,;-.97,5.27,;-.81,3.74,;.28,6.17,;1.68,5.55,;1.85,4.01,;3.25,3.39,;4.5,4.29,;5.91,3.67,;4.34,5.82,;5.58,6.73,;2.93,6.45,;-2.7,7.4,;-1.66,8.54,)|
Cn1nc(C2CC3CC(O)(CS(=O)(=O)CCCN4CCNC(=O)C4)CC3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |(-5,8.89,;-4.23,7.56,;-4.85,6.15,;-3.71,5.12,;-3.87,3.59,;-2.73,2.56,;-3.35,1.15,;-3.03,-.35,;-4.37,-1.12,;-3.03,-1.89,;-5.14,-2.46,;-4.37,-3.79,;-5.91,-3.79,;-5.14,-5.12,;-2.88,-4.19,;-2.48,-5.68,;-.99,-6.07,;-.59,-7.56,;.19,-8.89,;1.73,-8.89,;2.5,-7.56,;1.73,-6.23,;2.5,-4.89,;.19,-6.23,;-5.51,-.09,;-4.88,1.32,;-5.2,2.82,;-2.38,5.89,;-.97,5.27,;-.81,3.74,;.28,6.17,;1.68,5.55,;1.85,4.01,;3.25,3.39,;4.5,4.29,;5.91,3.67,;4.34,5.82,;5.58,6.73,;2.93,6.45,;-2.7,7.4,;-1.66,8.54,)|
Cn1nc([C@@H]2CC3CC(O)(CS(=O)(=O)CCCN4CCNCC4=O)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,25.27,(-5.32,8.75,;-4.49,7.45,;-5.06,6.02,;-3.87,5.04,;-3.96,3.5,;-5.26,2.67,;-4.88,1.18,;-5.45,-.25,;-4.26,-1.23,;-3.17,-2.32,;-5.03,-2.56,;-4.26,-3.9,;-5.8,-3.9,;-5.03,-5.23,;-2.72,-3.99,;-1.63,-5.08,;-.14,-4.68,;.95,-5.77,;-.14,-6.86,;.26,-8.35,;1.74,-8.75,;2.83,-7.66,;2.44,-6.17,;3.52,-5.08,;-2.96,-.4,;-3.34,1.09,;-2.78,2.52,;-2.57,5.86,;-1.14,5.3,;-.91,3.77,;.07,6.26,;1.5,5.69,;1.73,4.17,;3.16,3.6,;4.37,4.56,;5.8,3.99,;4.14,6.08,;5.34,7.04,;2.71,6.65,;-2.95,7.35,;-1.97,8.54,)|
COc1cc(ccc1[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1ncc[nH]1 |r|
COc1cc(ccc1[C@@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1ncc[nH]1 |r|
Cn1nc(C2CCC(C2)c2cnc(s2)C(F)(F)F)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc(C2CCC(C2)c2csc(n2)C(F)(F)F)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N
Cn1nc([C@@H]2CC3CC(O)(CN4CCCCC4)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:18.20,4.3,(2.69,7.54,;2.21,6.08,;3.12,4.83,;2.21,3.58,;2.69,2.12,;1.78,.87,;2.69,-.37,;2.69,-1.91,;4.15,-2.39,;5.64,-2.79,;4.55,-3.88,;3.46,-4.96,;1.98,-4.57,;.89,-5.65,;1.29,-7.14,;2.77,-7.54,;3.86,-6.45,;5.06,-1.14,;4.15,.1,;4.15,1.64,;.75,4.06,;-.5,3.16,;-1.9,3.78,;-.34,1.62,;-1.58,.72,;-1.42,-.81,;-2.67,-1.72,;-4.07,-1.09,;-5.32,-2,;-4.23,.44,;-5.64,1.07,;-2.99,1.34,;.75,5.6,;-.5,6.51,)|
Cn1nc([C@@H]2CC3CC(O)(CN4CCCCC4)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:18.20,(2.69,7.54,;2.21,6.08,;3.12,4.83,;2.21,3.58,;2.69,2.12,;1.78,.87,;2.69,-.37,;2.69,-1.91,;4.15,-2.39,;5.64,-2.79,;4.55,-3.88,;3.46,-4.96,;1.98,-4.57,;.89,-5.65,;1.29,-7.14,;2.77,-7.54,;3.86,-6.45,;5.06,-1.14,;4.15,.1,;4.15,1.64,;.75,4.06,;-.5,3.16,;-1.9,3.78,;-.34,1.62,;-1.58,.72,;-1.42,-.81,;-2.67,-1.72,;-4.07,-1.09,;-5.32,-2,;-4.23,.44,;-5.64,1.07,;-2.99,1.34,;.75,5.6,;-.5,6.51,)|
Cn1nc([C@@H]2CC3CC(O)(CN4CCOCC4)C[C@@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:18.20,4.3,(2.69,7.54,;2.21,6.08,;3.12,4.83,;2.21,3.58,;2.69,2.12,;1.78,.87,;2.69,-.37,;2.69,-1.91,;4.15,-2.39,;5.64,-2.79,;4.55,-3.88,;3.46,-4.96,;1.98,-4.57,;.89,-5.65,;1.29,-7.14,;2.77,-7.54,;3.86,-6.45,;5.06,-1.14,;4.15,.1,;4.15,1.64,;.75,4.06,;-.5,3.16,;-1.9,3.78,;-.34,1.62,;-1.58,.72,;-1.42,-.81,;-2.67,-1.72,;-4.07,-1.09,;-5.32,-2,;-4.23,.44,;-5.64,1.07,;-2.99,1.34,;.75,5.6,;-.5,6.51,)|
Cn1nc([C@@H]2CC3CC(O)(CN4CCOCC4)C[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r,wU:4.3,wD:18.20,(2.69,7.54,;2.21,6.08,;3.12,4.83,;2.21,3.58,;2.69,2.12,;1.78,.87,;2.69,-.37,;2.69,-1.91,;4.15,-2.39,;5.64,-2.79,;4.55,-3.88,;3.46,-4.96,;1.98,-4.57,;.89,-5.65,;1.29,-7.14,;2.77,-7.54,;3.86,-6.45,;5.06,-1.14,;4.15,.1,;4.15,1.64,;.75,4.06,;-.5,3.16,;-1.9,3.78,;-.34,1.62,;-1.58,.72,;-1.42,-.81,;-2.67,-1.72,;-4.07,-1.09,;-5.32,-2,;-4.23,.44,;-5.64,1.07,;-2.99,1.34,;.75,5.6,;-.5,6.51,)|
COc1cc(ccc1[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1cn(C)cn1 |r|
COc1cc(ccc1[C@@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1cn(C)cn1 |r|
COc1cc(ccc1[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1c[nH]cn1 |r|
COc1cc(ccc1[C@@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1c[nH]cn1 |r|
COc1cc(ccc1[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1nccn1C |r|
COc1cc(ccc1[C@@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1nccn1C |r|
COc1cc(ccc1C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1cnn(C)c1
COc1cc(ccc1C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1nccs1
COc1cc(ccc1C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)-c1cscn1
COc1cc(ccc1[C@H]1CC[C@H](C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)C(=O)NCCS(C)(=O)=O |r|
Cn1nc([C@@H]2CC3CCC[C@H]3C2)c(C(=O)Nc2ccc(F)c(Cl)c2)c1N |r|
COc1cc(ccc1C1CCC(C1)c1nn(C)c(N)c1C(=O)Nc1ccc(F)c(Cl)c1)C(O)NCCN
Cn1cc(C(=O)Nc2ccc(F)c(Cl)c2)c(n1)C1CC2CC(=O)CC2C1
Cn1cc(C(=O)Nc2ccc(F)c(Cl)c2)c(n1)C1CC2CC(O)(CS(C)(=O)=O)CC2C1 |(-2.94,5.78,;-2.31,4.38,;-.81,4.06,;-.64,2.53,;.69,1.76,;.69,.22,;2.02,2.53,;3.36,1.76,;3.36,.22,;4.69,-.55,;6.02,.22,;7.36,-.55,;6.02,1.76,;7.36,2.53,;4.69,2.53,;-2.05,1.9,;-3.08,3.04,;-2.37,.39,;-3.78,-.23,;-3.62,-1.77,;-4.39,-3.1,;-3.36,-4.24,;-2.59,-5.58,;-4.69,-5.01,;-6.02,-4.24,;-7.36,-5.01,;-6.02,-2.7,;-6.02,-5.78,;-1.95,-3.62,;-2.11,-2.09,;-1.34,-.75,)|