412 SMILES Strings for Ketohexokinase

Compound Name
SMILES String
Brc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
C(Nc1ncnc2c(NC3CC3)nc(nc12)N1CCNCC1)C1CC1
C(Nc1ncnc2c(NC3CCCCC3)nc(nc12)N1CCNCC1)C1CC1
C(Nc1ncnc2c(Nc3ccccc3)nc(nc12)N1CCNCC1)C1CC1
C(Nc1ncnc2c(Nc3ccccc3C3CC3)nc(nc12)N1CCNCC1)C1CC1
CC(C)N1CCN(CC1)c1ccc2c(C)nn(-c3ccccc3)c2c1
CC(C)c1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CC1CCCCN1c1nc(cc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
CC1CCCCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
CC1CCCN1c1nc(cc(C(F)F)c1C#N)N1CC2C(CC(O)=O)C2C1
CC1CCCN1c1nc(cc(C(F)F)c1C#N)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
CC1CN(CCN1)c1ccc2c(C)nn(-c3ccccc3)c2c1
CCCCCCNc1ncnc2c(Nc3ccccc3C)nc(nc12)N1CCNCC1
CCCNc1ncnc2c(Nc3ccccc3C)nc(nc12)N1CCNCC1
CCN(CC)c1ncnc2c(Nc3ccccc3C)nc(nc12)N1CCNCC1
CCN(CC1CCNCC1)c1ccc2c(SC)nn(-c3ccccc3)c2c1
CCN1CCN(CC1)c1ccc2c(C)nn(-c3ccccc3)c2c1
CCN1CCN(CC1)c1ccc2c(CC)nn(-c3ccccc3)c2c1
CCOc1cc(nc2n(nc(CC)c12)-c1ccccc1)-c1ccc(cc1)N1CC(C)NC(C)C1
CCOc1cc(nc2n(nc(CC)c12)-c1ccccc1)-c1ccc(cc1)N1CCN(C)CC1
CCOc1cc(nc2n(nc(CC)c12)-c1ccccc1)-c1ccc(cc1)N1CCNCC1
CCOc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CCSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CCc1c(nc(nc1C(F)(F)F)N1C[C@@H](O)[C@@H]1C)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
CCc1c(nc(nc1N1CC2C(CC(O)=O)C2C1)N1C[C@@H](O)[C@@H]1C)C(F)F
CCc1c(nc(nc1N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1)N1C[C@@H](O)[C@@H]1C)C(F)F
CCc1cc2nc(c(C#N)c(N3CCC(C)(O)C3)c2[nH]1)C(F)(F)F
CCc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CCc1nc(-c2ccccc2)n2cc(ccc12)N1CCNCC1
CCc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4[nH]cnc4c3)ccc12
CCc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4nc[nH]c4c3)ccc12
CCc1nn(-c2ccccc2)c2cc(NC(=O)c3cccc(c3)C(N)=N)ccc12
CCc1nn(-c2ccccc2)c2cc(OC3CN(C3)C3CCNCC3)ccc12
CCc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(OC2CCNCC2)cc1
CCc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(cc1)C1CCNC1
CCc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(cc1)N1CCNCC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CC2CNCC2C1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(C1)N1CCNCC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(CC1)N1CCNCC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCC2(CCNC2)C1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C)CC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNC2)C1=O
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNCC2)C1=O
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CNC1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)c1ccncc1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCNC(C)C1
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCNCC1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C(=O)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C1CCNC1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)c1cccnc1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)c1ccncc1
CCc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc(cc(O)c12)-c1ccc(NC2CCNCC2)cc1
CCc1nn(-c2ccccc2)c2nc(cc(OC)c12)-c1ccc(cc1)N1CC(C)NC(C)C1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)-c1ccc(cc1)N1CCNCC1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C(=O)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C1CCNC1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)c1cccnc1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)c1ccncc1
CCc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCNCC1
CCc1nn(-c2ccccc2)c2nc(ncc12)N1CCN(CC1)C1CNC1
CCc1nn(-c2ccccc2)c2nc(ncc12)N1CCN(CC1)c1cccnc1
CN1CC(C1)n1cc(cn1)-c1cc(nc(n1)N1CC[C@@H]1CO)C(F)(F)F |r|
CN1CCN(CC1)c1ccc2c(C)nn(-c3ccccc3)c2c1
CN1CCN(CC1)c1nc(Nc2ccccc2C)c2ncnc(NCC3CC3)c2n1
CNCCN(C)c1nc(Nc2ccccc2SC)c2ncnc(NCC3CC3)c2n1
CNc1ncnc2c(Nc3ccccc3C)nc(nc12)N1CCNCC1
COC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(cc(n1)N1CC[C@@H]1C)C(F)(F)F |r|
COC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(nc(n1)N1CC[C@@H]1C)C(F)(F)F |r|
COCCNc1ncnc2c(Nc3ccccc3SC)nc(nc12)N1CCNCC1
COc1c(nc(nc1C(F)(F)F)N1C[C@@H](O)[C@@H]1C)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
COc1c(nc(nc1N1CC2C(CC(O)=O)C2C1)N1C[C@@H](O)[C@@H]1C)C(F)F
COc1c(nc(nc1N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1)N1C[C@@H](O)[C@@H]1C)C(F)F |r|
COc1ccc(cc1)-n1nc(SC)c2ccc(cc12)C(=O)c1ccc2ncn(C)c2c1
COc1ccc(cc1)-n1nc(SC)c2ccc(cc12)C1=CCNCC1 |t:22|
COc1ccc(cc1)-n1nc(SC)c2ccc(cc12)N1CCNCC1
COc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
COc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4[nH]cnc4c3)ccc12
COc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4nc[nH]c4c3)ccc12
COc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(cc1)-n1ccnc1
COc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(cc1)N1CCNCC1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CC(C1)N1CCNCC1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNCC2)C1=O
COc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNC1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CNC1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)c1ccncc1
COc1nn(-c2ccccc2)c2cc(ccc12)N1CN(C1)C1CCNCC1
CS(=O)(=O)c1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CSc1ccc(Nc2nc(nc3c(NCC4CC4)ncnc23)N2CCNCC2)cc1
CSc1cccc(Nc2nc(nc3c(NCC4CC4)ncnc23)N2CCNCC2)c1
CSc1ccccc1Nc1nc(nc2c(N)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N(C)CC1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1C2CCC1CC(N)C2
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CC(CN)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CC2(CNC2)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CC1)C1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CC1)N1CCN(C)CC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CC1)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CN(C)C)CC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CN)CC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC2(CCNC2)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC2(CCNCC2)CC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC2(CNC2)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC[C@@H](N)C1 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC[C@@H]2CNC[C@H]12 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC[C@H](N)C1 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC[C@H]2CNC[C@@H]12 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(C)CC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNC(C)(C)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNC(C)C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNC[C@H]1C |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNc2ccccc2C1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1C[C@@H]2C[C@H]1CN2 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1C[C@H](C)N[C@H](C)C1 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CCC3)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCCC3CC3)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCc3ccccn3)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCc3cccs3)ncnc12)N1CCNCC1
CSc1ccccc1Nc1nc(nc2c(NCc3nccs3)ncnc12)N1CCNCC1
CSc1nn(-c2cc(F)cc(F)c2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
CSc1nn(-c2ccc(Br)cc2)c2cc(OC3CCNCC3)ccc12
CSc1nn(-c2ccc(Br)cc2)c2cc(OCC3CCNCC3)ccc12
CSc1nn(-c2ccc(C)cc2)c2cc(ccc12)C1=CCNCC1 |t:21|
CSc1nn(-c2ccc(F)cc2)c2cc(ccc12)C1=CCNCC1 |t:21|
CSc1nn(-c2ccc(F)cc2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
CSc1nn(-c2ccc(N)cc2)c2cc(CN3CCNCC3)ccc12
CSc1nn(-c2ccc(N)cc2)c2cc(ccc12)C(=O)NC1CCNCC1
CSc1nn(-c2ccc(N)cc2)c2cc(ccc12)C1=CCNCC1 |t:21|
CSc1nn(-c2ccc(cc2)[N+]([O-])=O)c2cc(CN3CCNCC3)ccc12
CSc1nn(-c2ccc(cc2)[N+]([O-])=O)c2cc(ccc12)C(=O)N1CCNCC1
CSc1nn(-c2ccc(cc2)[N+]([O-])=O)c2cc(ccc12)C(=O)NC1CCNCC1
CSc1nn(-c2ccc(cc2)[N+]([O-])=O)c2cc(ccc12)C1=CCN(CC1)C(=O)CN |t:23|
CSc1nn(-c2ccc(cc2)[N+]([O-])=O)c2cc(ccc12)C1=CCNCC1 |t:23|
CSc1nn(-c2cccc(C)c2)c2cc(ccc12)C1=CCNCC1 |t:21|
CSc1nn(-c2cccc(C)c2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
CSc1nn(-c2cccc(C)c2)c2cc(ccc12)N1CCNCC1
CSc1nn(-c2cccc(F)c2)c2cc(ccc12)C1=CCNCC1 |t:21|
CSc1nn(-c2ccccc2)c2c(OC3CCNCC3)cccc12
CSc1nn(-c2ccccc2)c2c(OCC3CCNCC3)cccc12
CSc1nn(-c2ccccc2)c2c(cccc12)C1=CCNCC1 |t:20|
CSc1nn(-c2ccccc2)c2cc(C=CC3CCCN3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=CC3CCCNC3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=CC3CCNCC3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=Cc3ccc(C)nc3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=Cc3ccccn3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=Cc3ccncc3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(C=Cn3cncn3)ccc12 |w:14.14|
CSc1nn(-c2ccccc2)c2cc(CCC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3(C)CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3(CCNCC3)c3ccccc3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3(F)CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3(N)CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3CCCN3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3CCCNC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3CCNC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)C3CNC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)CC3CCCCN3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)CC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)CCN3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)CN3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)Cc3ccncc3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)NC3CCNC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)NC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)c3cccnc3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC(=O)c3ccncc3)ccc12
CSc1nn(-c2ccccc2)c2cc(NC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NCC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NCCC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(NCCN3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(OC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(OCC3CCNCC3)ccc12
CSc1nn(-c2ccccc2)c2cc(ccc12)-c1ccncc1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)C(=O)N1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)C1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)CC1CCCN1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)CC1CCCNC1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)CC1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)c1ccc2ncn(C)c2c1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(=O)c1ccc2nonc2c1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(O)C1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)C(O)c1ccncc1
CSc1nn(-c2ccccc2)c2cc(ccc12)C1=CCN(CC1)C(=O)CCN |t:20|
CSc1nn(-c2ccccc2)c2cc(ccc12)C1=CCNCC1 |t:20|
CSc1nn(-c2ccccc2)c2cc(ccc12)C1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CC(C1)N1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CC2CC1CN2
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(C1)N1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(CC1)N1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNC2)C1=O
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNCC2)C1=O
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)C1CCCCN1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)C1CCCN1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)C1CCCNC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)C1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)c1ccccn1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)c1cccnc1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C(=O)c1ccncc1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CNC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)c1ccccn1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)c1ccncc1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC2CCCNC2)C1=O
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC2CCNC2)C1=O
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(Cc2cccnc2)CC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(Cc2ccncc2)CC1
CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCNCC1
CSc1nn(-c2ccccc2C)c2cc(ccc12)C1=CCNCC1 |t:21|
C[C@@H]1N(C[C@@]1(C)O)c1nc(C(F)F)c(C)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@@H]1N(C[C@@]1(C)O)c1nc(C(F)F)c(C)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(C(F)F)c(Cl)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@@H]1N(C[C@@]1(C)O)c1nc(C(F)F)c(Cl)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(N2CC3C(CC(O)=O)C3C2)c(C)c(n1)C(F)(F)F
C[C@@H]1N(C[C@@]1(C)O)c1nc(N2CC3C(CC(O)=O)C3C2)c(Cl)c(C(F)F)c1C#N
C[C@@H]1N(C[C@@]1(C)O)c1nc(N2CC3C(CS(C)(=O)=O)C3C2)c(Cl)c(n1)C(F)(F)F
C[C@@H]1N(C[C@@]1(C)O)c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C)c(n1)C(F)(F)F |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(N2C[C@H]3[C@H](CS(C)(=O)=O)[C@H]3C2)c(Cl)c(n1)C(F)(F)F |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(cc(C(F)F)c1C#N)N1CC2C(CC(O)=O)C2C1
C[C@@H]1N(C[C@@]1(C)O)c1nc(cc(C(F)F)c1C#N)N1C[C@]2(C)[C@H](CC(O)=O)[C@]2(C)C1 |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(cc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@@H]1N(C[C@@]1(C)O)c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@@H]1N(C[C@@]1(C)O)c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CS(C)(=O)=O)[C@H]2C1 |r|
C[C@@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r|
C[C@H]1CCCN1c1nc(cc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1CCCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1CCN1c1nc(C(F)F)c(C)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@H]1CCN1c1nc(C(F)F)c(C)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1
C[C@H]1CCN1c1nc(C(F)F)c(Cl)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@H]1CCN1c1nc(C(F)F)c(Cl)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1
C[C@H]1CCN1c1nc(N2CC3C(CC(O)=O)C3C2)c(C)c(n1)C(C)(F)F
C[C@H]1CCN1c1nc(N2CC3C(CC(O)=O)C3C2)c(C)c(n1)C(F)(F)F
C[C@H]1CCN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C)c(n1)C(C)(F)F
C[C@H]1CCN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C)c(n1)C(F)(F)F
C[C@H]1CCN1c1nc(cc(C(F)F)c1C#N)N1CC2C(CC(O)=O)C2C1
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cn[nH]c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(=O)N(CCO)CCO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(=O)N2CCN(C)CC2)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(=O)N2C[C@@H](O)[C@H](O)C2)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(=O)N2C[C@H](O)[C@@H](O)C2)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(=O)NCCO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CC(O)CO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CCN(C)C)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(CCO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(C[C@@H](O)CO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(C[C@H](O)CO)c1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCN(C)CC1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCN(CC1)C(=O)CN |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCN(CC1)C(C)=O |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCN(CCO)CC1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCNCC1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCNCC1O |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCOCC1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CNC1 |r|
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)N1CC(CC(O)=O)C1
C[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)N1CC[C@H](CC(O)=O)C1
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2CCNC(C)(C)C2)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2CCNCC2)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2CCNC[C@@H]2C)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2CCN[C@@H](C)C2)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2C[C@@H](C)NC[C@@H]2C)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)NCCN)c1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CCNCC1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CN(C)C1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CNC1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(=O)NS(C)(=O)=O)[C@H]2C1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](Cc3nnn[nH]3)[C@H]2C1 |r|
C[C@H]1CCN1c1nc(cc(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1)C(F)F |r|
C[C@H]1C[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(Cl)c(n1)C(F)(F)F |r|
C[C@H]1C[C@H](O)CN1c1nc(c(Cl)c(n1)C12CNCC1C2CC(O)=O)C(F)(F)F
C[C@H]1C[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)C12CNCC1C2CC(O)=O
C[C@H]1C[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1
C[C@H]1[C@H](O)CN1c1cc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(Cl)c(n1)C(C)(F)F |r|
C[C@H]1[C@H](O)CN1c1cc(cc(n1)C(C)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1cc(cc(n1)C(C)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1cc(cc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1cc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1cc(nc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(C)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(C)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(C2CC2)c(n1)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(C2CC2)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(Cl)c(n1)C12CNCC1C2CC(O)=O
C[C@H]1[C@H](O)CN1c1nc(C(F)F)c(Cl)c(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(N2CC3C(CC(O)=O)C3C2)c(C#N)c(n1)C(F)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2CC3C(CC(O)=O)C3C2)c(Cl)c(n1)C(C)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2CC3C(CC(O)=O)C3C2)c(Cl)c(n1)C(F)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2CC3C(CC(O)=O)C3C2)c(F)c(c1C#N)C(C)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C#N)c(n1)C(F)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C)c(n1)C(C)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C)c(n1)C(F)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(C2CC2)c(n1)C(F)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(Cl)c(c1C#N)C(F)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(Cl)c(n1)C(C)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(Cl)c(n1)C(F)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(F)c(C(F)F)c1C#N |r|
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(F)c(c1C#N)C(C)(F)F
C[C@H]1[C@H](O)CN1c1nc(N2C[C@H]3[C@H](CC(O)=O)[C@H]3C2)c(F)c(n1)C(C)(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(c(C)c(n1)C12CNCC1C2CC(O)=O)C(C)(F)F
C[C@H]1[C@H](O)CN1c1nc(c(C)c(n1)C12CNCC1C2CC(O)=O)C(F)(F)F
C[C@H]1[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCNCC1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)N1CC2C(CCC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@H](O)C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(C)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(C)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CN(C)C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CNC1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)[C@@H]1CCNC1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)[C@H]1CCNC1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)C(F)(F)F)N1C[C@H]2[C@H](CCC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(cc(n1)N1CC2C(CC(O)=O)C2C1)C(F)F
C[C@H]1[C@H](O)CN1c1nc(cc(n1)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1)C(F)F |r|
C[C@H]1[C@H](O)CN1c1nc(nc(c1C#N)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(nc(c1C#N)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@H]1[C@H](O)CN1c1nc(nc(n1)C(F)(F)F)N1CC2C(CC(O)=O)C2C1
C[C@H]1[C@H](O)CN1c1nc(nc(n1)C(F)(F)F)N1C[C@H]2[C@H](CC(O)=O)[C@H]2C1 |r|
C[C@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r|
C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1CCN(CCO)CC1 |r|
C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r|
C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@H](O)C1 |r|
Cc1c[nH]c2ncnc(N3CCC[C@@H](CO)C3)c12 |r|
Cc1cc(C)c(C#N)c(n1)N1CCOCC1
Cc1cccc(Nc2nc(nc3c(NCC4CC4)ncnc23)N2CCNCC2)c1
Cc1cccc(c1)-n1ncc2ccc(NC(=O)C3CCN3)cc12
Cc1cccc(c1)-n1ncc2ccc(NC(=O)C3CNC3)cc12
Cc1cccc(c1)-n1ncc2ccc(cc12)-c1ccnc(N)c1
Cc1cccc(c1)-n1ncc2ccc(cc12)C(=O)NC1CCNCC1
Cc1cccc(c1)-n1ncc2ccc(cc12)C(=O)NC1CNC1
Cc1ccccc1Nc1nc(NC2CCNCC2)nc2c(NCC3CC3)ncnc12
Cc1ccccc1Nc1nc(nc2c(NC3CCCCC3)ncnc12)N1CCNCC1
Cc1ccccc1Nc1nc(nc2c(NCC#C)ncnc12)N1CCNCC1
Cc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(CN)CC1
Cc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCC(N)CC1
Cc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCCNCC1
Cc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
Cc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCOCC1
Cc1ccccc1Nc1nc(nc2c(NCc3ccccc3)ncnc12)N1CCNCC1
Cc1ccccc1Nc1nc(nc2c(NCc3cccs3)ncnc12)N1CCNCC1
Cc1ccccc1Nc1nc(nc2c(NCc3nccs3)ncnc12)N1CCNCC1
Cc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4[nH]cnc4c3)ccc12
Cc1nn(-c2ccccc2)c2cc(NC(=O)c3ccc4nc[nH]c4c3)ccc12
Cc1nn(-c2ccccc2)c2cc(ccc12)-c1ccc(cc1)N1CCNCC1
Cc1nn(-c2ccccc2)c2cc(ccc12)C1CCC(CC1)N1CCNCC1 |(1.1,7.3,;.33,5.97,;-1.19,5.73,;-1.43,4.21,;-2.76,3.44,;-4.1,4.21,;-5.43,3.44,;-5.43,1.9,;-4.1,1.13,;-2.76,1.9,;-.06,3.51,;.34,2.02,;1.83,1.62,;2.92,2.71,;2.52,4.2,;1.03,4.6,;2.23,.13,;1.14,-.95,;1.54,-2.44,;3.02,-2.84,;4.11,-1.75,;3.71,-.26,;3.42,-4.33,;2.33,-5.42,;2.73,-6.9,;4.22,-7.3,;5.31,-6.21,;4.91,-4.73,)|
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CC(C1)N1CCNCC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(C1)N1CCNCC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(CC1)N1CCNCC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCC(N)C1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C2CCNCC2)C1=O
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNCC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CNC1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)c1ccncc1
Cc1nn(-c2ccccc2)c2cc(ccc12)N1CCNCC1
Cc1nn(-c2ccccc2)c2nc(CC3CCN(CC3)C3CNC3)[nH]c(=O)c12
Cc1nn(-c2ccccc2)c2nc(CC3CCN(CC3)C3CNC3)nc(O)c12
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCCN(C1)C1CNC1
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C(=O)C1CCNCC1
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C1CCNC1
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)C1CCNCC1
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCN(CC1)c1cccnc1
Cc1nn(-c2ccccc2)c2nc([nH]c(=O)c12)C1CCNCC1
Cc1nn(-c2ccccc2)c2nc(cc(CO)c12)-c1ccc(cc1)N1CCNCC1
Cc1nn(-c2ccccc2)c2nc(cc(O)c12)-c1ccc(NC2CCNCC2)cc1
Cc1nn(-c2ccccc2)c2nc(cc(O)c12)-c1ccc(cc1)N1CCNCC1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCCN(C1)C1CNC1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C(=O)C1CCNCC1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C1CCNC1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)C1CCNCC1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCN(CC1)c1cccnc1
Cc1nn(-c2ccccc2)c2nc(nc(O)c12)C1CCNCC1
Clc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
Cn1nc(-c2ccccc2)c2cc(ccc12)N1CCNCC1
FC(F)(F)Sc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
Fc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1
Nc1cc(ccn1)-c1ccc2c(nn(-c3ccccc3)c2c1)C1CC1
Nc1cc(ccn1)-c1ccc2cnn(-c3ccccc3)c2c1
Nc1nc(Cl)c(cc1F)C#N
O=C(NC1CCNCC1)c1ccc2cnn(-c3ccccc3)c2c1
O=C(NC1CNC1)c1ccc2cnn(-c3ccccc3)c2c1
OC(=O)CC1C2CN(CC12)c1cc(C(F)F)c(C#N)c(NC2CCC2)n1
OC(=O)CC1C2CN(CC12)c1cc(C(F)F)c(C#N)c(n1)N1CCCC1
OC(=O)CC1C2CN(CC12)c1cc(c(C#N)c(n1)C1CCC1)C(F)(F)F
OC(=O)CC1C2CN(CC12)c1cc(c(C#N)c(n1)N1CCC1)C(F)(F)F
OC(=O)CC1C2CN(CC12)c1cc(nc(n1)N1CCC1)C(F)(F)F
OC(=O)CC1[C@H]2CN(C[C@H]12)c1cc(nc(n1)C1CCC1)C(F)(F)F |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(C(F)F)c(C#N)c(NC2CCC2)n1 |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(C(F)F)c(C#N)c(n1)N1CCCC1 |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(c(C#N)c(n1)N1CCC1)C(F)(F)F |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(nc(n1)C1CCC1)C(F)(F)F |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1cc(nc(n1)N1CCC1)C(F)(F)F |r|
OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1nc(C2CCC2)c(C#N)c(n1)C(F)(F)F |r|
OCCN1CCN(CC1)c1cc(c(C#N)c(n1)N1CCCC(CO)C1)C(F)(F)F
OC[C@H]1CCN1c1nc(cc(c1C#N)C(F)(F)F)-c1cnn(c1)C1CCNCC1 |r|
OC[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CCNCC1 |r|
OC[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)C1CNC1 |r|
OC[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(c1)[C@@H]1CCNC1 |r|
Oc1nc2ccccc2nc1C(F)(F)F
[H][C@@]12CN(C[C@]1([H])[C@H]2C(O)=O)c1cc(c(C#N)c(n1)N1C[C@@H](O)[C@@H]1C)C(F)(F)F |r|
[H][C@@]12CN(C[C@]1([H])[C@H]2CO)c1cc(c(C#N)c(n1)N1C[C@@H](O)[C@@H]1C)C(F)(F)F |r|