443 SMILES Strings for Mitogen-activated protein kinase kinase kinase 13

Compound Name
SMILES String
CC(C)(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCCC1
CC(C)(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1
CC(C)(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1nc2ccccc2o1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
CC(C)(C)c1cnc(CSc2cnc(NC(=O)C3CCNCC3)s2)o1
CC(C)(CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1
CC(C)C(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NC1CCCCC1
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NCc1ccccc1
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NCc1nc2ccccc2o1
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](C)c1ccccc1 |r|
CC(C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N(C)[C@@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC(COC(F)(F)F)c1ccccc1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1(CCCC1)c1ccc(F)cc1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CC(C)(C)Oc2ccccc12
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCCC1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCc2cc(F)ccc12
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1COC1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCC1CC1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1nc2ccccc2o1
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(C)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(cc1)C(F)(F)F |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccccc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1nc2ccccc2o1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H](C)c1ccccc1 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H]1CCCc2ccccc12 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H]1CCOc2ccccc12 |r|
CC(C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(N)=O
CC(C)NC(=O)c1cc(cn2ncnc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)NC(=O)c1cc(cn2ncnc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CC(C)NS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC(C)Oc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
CC(C)c1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CC(C)c1csc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1
CC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(F)(F)F
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1F
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OC(F)(F)F)cc1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OCC(F)F)cc1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(cc1)C(C)(C)C
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cn[nH]c1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cnn(C)c1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc(C)c(C)s1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2CCCCc2s1
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2ccccc2n1C
CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nccn1C
CC(O)c1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CC1(C)CC(NC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c2ccccc2O1
CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12
CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccc(F)cc1 |r|
CCC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CCC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
CCN(CC)Cc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1
CCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1
CCN1CCCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CCN1CCC[C@H](C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
CCNC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CCNC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CCNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CCNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1cccc(OC)c1
CCNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1
CCNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccccc1 |r|
CCNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CCNS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CCO[C@H]1CC[C@@H](CC1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r,wU:6.9,wD:3.2,(-10.69,-2.07,;-9.17,-2.3,;-8.2,-1.11,;-6.67,-1.29,;-6.07,-2.71,;-4.54,-2.9,;-3.62,-1.67,;-4.21,-.26,;-5.74,-.07,;-2.08,-1.82,;-1.19,-.57,;-1.83,.83,;.34,-.72,;1.37,.44,;2.78,-.18,;2.63,-1.71,;1.13,-2.04,;4.11,.59,;4.11,2.13,;5.44,2.9,;6.78,2.13,;8.24,2.61,;9.15,1.36,;10.69,1.36,;8.24,.12,;6.78,.59,;5.44,-.18,)|
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
CCOc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
CCOc1cccc(CNC(=O)c2cc(cs2)-c2ccn3nc(N)nc3c2)c1
CCOc1ccccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CC[C@@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccc(F)cc1 |r|
CC[C@@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H](CC)c1ccc(F)cc1 |r|
CC[C@@H](NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(F)(F)F |r|
CC[C@@H](NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1)C(F)(F)F |r|
CC[C@@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)NCc1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cc2nc(N)nn12)-c1csc(c1)C(=O)N[C@@H](COC)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1(CCCC1)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccccc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccccc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](COC)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](COC)c1ccccc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H](CC)c1ccc(F)cc1 |r|
CC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@H]1CCOc2ccccc12 |r|
CC[C@H](NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(F)(F)F |r|
CC[C@H](NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1)C(F)(F)F |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2cnn(CC(F)(F)F)c2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2cnn(CC(F)(F)F)c2)n2nc(N)nc2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2nnc(s2)[C@@H](C)CO)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)C)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)C)c2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)n2nc(N)nc2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)n2nc(N)nc2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)CF)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2(CO)CC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2COC2)c2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@@H](C)CO)c2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@@H](C)COC)c2nc(N)nn2c1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@@H]2CCOC2)c2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)n2nc(N)nc2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|
CC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
CCc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CCc1nnc(o1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CCc1nnc(o1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CCc1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CCc1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1ccc(n1)C(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CN(C)C(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 |r|
CN(C1CCCCC1)C(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CN(CCc1ccccc1)C(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
CN1C2CCC1CC(C2)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |TLB:0:1:3.4:6.8.7|
CN1CCCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CN1CCCCC1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
CN1CCN(Cc2ccc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)cc2)CC1
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nc(cs3)-c3cccnc3)c2)CC1
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
CN1CCO[C@H](CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)C1 |r|
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1
CNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
CNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1cccc(OC)c1
CNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1
CNC(=O)c1ccccc1Sc1ccc2c(\C=C\c3ccccn3)n[nH]c2c1
CNS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COC1CCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COCCCNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COCCNC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
COCCOc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1 |r|
COC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1 |r,$;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
COC[C@H](C)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccccc1 |r,$;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COC[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1)c1ccccc1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)n2nc(N)nc2c1)c1ccccc1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccccc1 |r|
COC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|
COCc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
COCc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc(OC)c1
COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)ccc1F
COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)ccn1
COc1cc(Nc2c(cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1cc(Nc2ncc(F)c(Nc3ccc4OC(C)(C)C(=O)Nc4n3)n2)cc(OC)c1OC
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
COc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1
COc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1OC
COc1ccc(COc2ccc(Cc3cnc(N)nc3N)cc2OC)cc1
COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(CC2)S(C)(=O)=O)nc1N
COc1ccc(cc1)C(C)(C)NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1
COc1ccc(cc1)[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
COc1ccc2OC(C)(C)CC(NC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)c2c1
COc1ccc2n(C)c(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc2c1
COc1ccc2oc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc2c1
COc1cccc(CCNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COc1cccc(CN(C)C(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(c(C)s2)-c2ccc3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)N(C)C)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC(C)(C)C)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC(C)C)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC(C)C)c3ncnn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC(C)C)n3nc(N)nc3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC3CCNC3)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC3CNC(=O)C3)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)N[C@@H](C)CO)c3nc(N)nn3c2)c1 |r|
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(F)c3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cc(c3nc(N)nn3c2)C(F)(F)F)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1
COc1cccc(CNC(=O)c2cc(cs2)-c2ccn3nc(N)nc3c2)c1
COc1cccc(CNC(=O)c2cc(cs2)-c2cn3nc(N)nc3cc2F)c1
COc1cccc(c1)C(C)(C)NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C)c2nc(N)nn2c1
COc1cccc(c1)C(C)(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COc1cccc(c1)C(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COc1cccc(c1)C(CCO)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COc1cccc(c1)C1(CC1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COc1cccc(c1)[C@@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
COc1cccc(c1)[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
COc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
COc1ccnc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
COc1cncc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CSc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-12.18,1.86,;-10.84,1.09,;-9.51,1.86,;-9.51,3.4,;-8.18,4.17,;-6.84,3.4,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-8.18,1.08,)|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N(C)[C@@H](C)c1ccc(F)cc1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCCC1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1nc2ccccc2o1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccccc1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1nc2ccccc2o1 |r|
C[C@@H](CO)NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(N)=O |r|
C[C@@H](CO)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cccc(Cl)c1 |r|
C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
C[C@H](NC(=O)c1cc(c(F)s1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)C)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)C)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)CO)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)(C)CO)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C(F)(F)F)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC(C)C(F)(F)F)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CC2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCC2)c2nc(N)nn2c1)c1ccc(cc1)C(F)(F)F |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCC2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCNC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CCNC2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CNC(=O)C2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CNC(=O)C2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2CNC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r,$;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2COC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NC2COC2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NCC(F)(F)F)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)NCC(F)(F)F)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H](CO)C(F)(F)F)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(C)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccc(cc1)C(F)(F)F |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(C(=O)N[C@H]2CCOC2)c2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(F)c2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(c2nc(N)nn2c1)C(F)(F)F)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1cc(c2nc(N)nn2c1)C(F)(F)F)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(C)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(Cl)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OC(F)(F)F)cc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(cc1)C(F)(F)F |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cccc(Cl)c1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1F |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2ccccc2o1 |r|
C[C@H](NC(=O)c1cc(cs1)-c1ccn2nc(N)nc2c1)c1ccc(F)cc1 |r|
C[C@H](NC(=O)c1scc(c1C)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|
C[C@H]1CCC[C@@H](C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
C[C@H]1CCC[C@H](C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|
C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4C(=O)NCc4c4c5ccccc5n2c4c13 |r|
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
Cc1c(csc1C(=O)NCc1ccc(F)cc1)-c1ccc2nc(N)nn2c1
Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCCC1
Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Cc1cccc(C)c1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Cc1cccc(C)c1NC(=O)c1cc(cs1)-c1ccn2nc(N)nc2c1
Cc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
Cc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1C
Cc1cccc2oc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc12
Cc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Cc1cn(C)nc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
Cc1csc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NC1CCCCC1
Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1ccc(F)cc1
Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1ccccc1
Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1nc2ccccc2o1
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
Cn1cc(Nc2nccc(n2)-c2ccc3[C@@H](CCN(Cc3c2)C2COC2)NC(=O)c2cn(nn2)C(C)(C)C)cn1 |r|
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
Cn1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1
Cn1cccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Cn1ccnc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Cn1cnc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1
Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
Cn1nccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
Fc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)cc1Cl
Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)|
N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r|
NC(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
Nc1nc2c(F)cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NC1CCCCC1)C(F)(F)F
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1CC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1CCC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1CCNC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1CNC(=O)C1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1CNC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;$|
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NC1COC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)NCC(F)(F)F
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)N[C@H](CO)C(F)(F)F |r|
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(=O)N[C@H]1CCOC1 |r|
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(F)(F)F
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NC1CC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NC1CCC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NC1CCNC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NC1CNC(=O)C1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NC1COC1
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)NCC(F)(F)F
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(=O)N[C@H]1CCOC1 |r|
Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(F)(F)F
Nc1nc2cc(F)c(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Nc1nc2cc(F)c(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1
Nc1nc2cc(cc(C(O)=O)n2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCC1CCCCC1
Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1
Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCc1ccccc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(C1CC1)c1ccccc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(CO)c1ccc(F)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(c1ccc(F)cc1)C(F)(F)F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CC1)c1ccc(F)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CCC1)c1ccc(F)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CCCC1)c1ccc(F)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(COC1)c1ccc(F)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCC(C1)C(F)(F)F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCCCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCOC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCc2cc(F)ccc12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOc2ccc(F)cc12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOc2ccccc12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCc2ccccc12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1COC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1COc2ccc(F)cc12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCOC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCOCC1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1COCCO1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCCc1ccccc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCc1c(F)cccc1Cl
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCc1ccccc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1c(F)cccc1F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cc(F)cc(F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCCC2)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCCC2=O)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCOCC2)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(Cl)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)c(F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(OCCN2CCCCC2)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(OCCN2CCOCC2)cc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc2OCOc2c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(Cl)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC(F)(F)F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC(F)F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC2CC2)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OCC(F)(F)F)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OCCN2CCOCC2)c1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(c1)C#N
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(c1)C(O)=O
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1C(F)(F)F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1Cl
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccnc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccco1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccs1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccoc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccsc1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cn2ccccc2n1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cnc(Cl)s1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cnc2ccccn12
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1nc(cs1)C(F)(F)F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1nc2ccccc2o1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ncco1
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)N[C@@H](CCO)c1ccc(F)cc1 |r|
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)N[C@H](c1ccccc1)C(F)(F)F |r|
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1CO
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1Cl
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1OC(F)(F)F
Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1OC(F)F
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
[H][C@@]12CN(C[C@]1([H])[C@H]2c1cc(nn1C(C)C)-c1cnc(N)c(OC(F)(F)F)c1)C1COC1 |r|
[H][C@@]12CN(C[C@]1([H])[C@H]2c1cc(nn1CC1CC1)-c1cnc(N)c(c1)C(F)(F)F)C1COC1 |r|