3021 SMILES Strings for Aurora kinase B

Compound Name
SMILES String
CN1c2ccccc2C(=O)N(C)c2ccc(Nc3ccc(cc3)S(N)(=O)=O)nc12
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3Cl)C(O)=O)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(c3F)C(F)(F)F)C(O)=O)ccc2F)n[nH]1
COc1ccc(CC2(CCN(CC2)C(=O)c2cccc(Cl)c2F)C(O)=O)nc1Nc1cc(C)[nH]n1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)C(O)=O)ccc2Cl)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)C(O)=O)ccc2F)n[nH]1
CNC(=O)C1(Cc2ccc(F)c(Nc3cc(C)[nH]n3)n2)CCN(CC1)C(=O)c1cccc(Cl)c1F
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)C(=O)NC3CC3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)C(=O)N3CCC3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)c3noc(C)n3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)c3ncon3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)c3nnc(C)o3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)c3nc(C)no3)ccc2F)n[nH]1
Cc1cc(Nc2nc(CC3(CCN(CC3)C(=O)c3cccc(Cl)c3F)C(O)=O)ccc2C#N)n[nH]1
COc1cc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2OC)ccc1C(O)=O |c:11|
CN1CCN(CC1)c1ccc(cc1)C(=O)Nc1[nH]nc2CN(Cc12)C(=O)[C@H](F)c1ccccc1 |r|
CN1CCN(CC1)c1ccc(cc1)C(=O)Nc1[nH]nc2CN(Cc12)C(=O)[C@H](O)c1ccccc1 |r|
C[C@@H](C(=O)N1Cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1)c1ccccc1 |r|
CO[C@@H](C(=O)N1Cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1)c1ccccc1 |r|
C[C@H](C(=O)N1Cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1)c1ccccc1 |r|
CO[C@H](C(=O)N1Cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1)c1ccccc1 |r|
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
C(Nc1nc(nc2cccc(-c3ccccc3)c12)-c1cncnc1)c1ccccn1
O=C1Nc2ccccc2[C@]11CC1c1ccc2cn[nH]c2c1 |r|
COc1ccc2NC(=O)C3(CC3c3ccc4c(I)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(I)n[nH]c4c3)c2c1 |r|
Ic1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccccc12 |r|
Ic1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12 |r|
Ic1n[nH]c2cc(ccc12)[C@H]1C[C@]11C(=O)Nc2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@]3(C[C@@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccccc12 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccc(Br)cc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCOCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCNCC3)c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3ccncc3)n[nH]c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@H]2C[C@]22C(=O)Nc3ccccc23)cc1 |r|
Brc1cnc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5cccnc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3cccnc3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@@]11C[C@@H]1c1ccc2c(\C=C\c3cccnc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(nc5)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@]3(C[C@@H]3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccnc(c3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
Fc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(I)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3cccc(CO)c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3cccc(CN4CCCCC4)c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(CO)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3cccc(c3)N3CCNCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCNCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCNCC3)c2c1 |r|
COc1ccc2NC(=O)[C@]3(C[C@@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCNCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CCN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)C3(CC3c3ccc4c(n[nH]c4c3)C#Cc3cccnc3)c2c1
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccccn3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(cc3)C#N)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CN4CCOCC4)cc3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CN4CCCCC4)cc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCCCC6)cc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3ccc(CN4CCCC4)cc3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CN4CCCC4)cc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCCCC6)nc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CN4CCCCC4)nc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc6CCN(C)Cc6c5)n[nH]c4c3)c2c1 |r|
CN1CCc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2C1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc6CCNCc6c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(OCCN4CCCCC4)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(OCCN4CCOCC4)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(OCCN(C)C)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc4CCN(C)Cc4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc4CCNCc4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CN4CCCOCC4)cc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCCOCC6)cc5)n[nH]c4c3)c2c1 |r|
CN1CCc2cc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)ccc2C1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc6CN(C)CCc6c5)n[nH]c4c3)c2c1 |r|
CN1CCc2cc(ccc2C1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12 |r|
CN1CCC(CC1)Oc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(OC6CCN(C)CC6)cc5)n[nH]c4c3)c2c1 |r|
CC(C)(N1CCOCC1)c1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
CN1CCC(Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2)CC1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CC6CCN(C)CC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@@H]3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
CN1CCN(CC1)c1ccc(cc1)-c1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccc(N)cc12 |r|
CN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(CN5CCOCC5)cc4)n[nH]c3c2)c2ccccc12 |r|
CN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(cc4)N4CCNCC4)n[nH]c3c2)c2ccccc12 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(cc3)N3CCNCC3)n[nH]c2c1 |r|
CN1C(=O)[C@@]2(C[C@H]2c2ccc3c(n[nH]c3c2)-c2ccc(nc2)N2CCN(C)CC2)c2ccccc12 |r|
CN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(CN5CCCCC5)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(CC3)C(C)C)c2c1 |r|
CCN1CCN(CC1)c1ccc(cc1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12 |r|
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCNCC3)c2c1 |r|
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)s5)n[nH]c4c3)c2c1 |r|
F[C@@H]1CCN(Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2)C1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc4nccn4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(OCCn4ccnc4)cc3)c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)N(C)c3ccccc23)cc1 |r|
CN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(nc4)N4CCN(C)CC4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccncc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CC[C@@H](F)C6)cc5)n[nH]c4c3)c2c1 |r|
Fc1cc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc(F)c1CN1CCOCC1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCC(O)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCC(CC3)N(C)C)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCC(CC3)N3CCOCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)C3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CC[C@H](C3)N(C)C)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N(C)CCN(C)C)c2c1 |r|
NS(=O)(=O)c1cccc(c1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12 |r|
COCCN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(CN(C)C)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cccc(CN6CCOCC6)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cccc(CN(C)C)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3cccc(CN4CCOCC4)c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)C#Cc3ccc(C=O)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)C#Cc3ccc(CN4CCOCC4)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(CN4CCOCC4)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(CN4CCN(C)CC4)cc3)c2c1 |r|
CCc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3cccc(CN4CCOCC4)c3)c2c1 |r|
CCc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)C#Cc3ccc(CN4CCN(C)CC4)cc3)c2c1 |r|
CCN(CC)Cc1c(F)cc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)cc1F |r|
CN1CCN(Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2)CC1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)C(=O)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1 |r|
Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cn1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3cccc(CN4CCOCC4)c3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3cccc(CN4CCOCC4)c3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(n[nH]c2c1)-c1ccc(CN2CCOCC2)cc1 |r|
CN1CCN(Cc2ccc(cc2)-c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)CC1 |r|
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12 |r|
Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)c(C)n1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(CCN4CCOCC4)cc3)c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)N(CC(N)=O)c3ccccc23)cc1 |r|
Cc1cc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)ccn1 |r|
CN(C)Cc1cccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(nc5)N5CCNCC5)n[nH]c4c3)c2c1 |r|
CN(C)Cc1cccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)N(CC(N)=O)c3ccccc23)c1 |r|
NC(=O)CN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(CN5CCCCC5)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
CCc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
COc1cc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2cc1OC |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccc(C)cc23)cc1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccc(Cl)cc23)cc1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ncccc23)cc1 |r|
CN1CCN(CC1)c1ccc(cc1)-c1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccc(C)cc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(cc5)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(cc5)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
CC(C)CCN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(CN(C)C)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CCN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(cc5)C(=O)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
COCCN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(CN(C)C)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5csc(CN(C)C)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(cc5)N5CCNCC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5csc(CN6CCOCC6)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5csc(CN6CCOCC6)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6C[C@H](C)O[C@H](C)C6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN6C[C@H](C)O[C@H](C)C6)cc5)n[nH]c4c3)c2c1 |r|
CCN1CCN(CC1)c1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)cc1 |r|
CCN1CCN(CC1)c1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccc(OC)cc23)cc1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(cc5)N5CCN(CC5)C(C)C)n[nH]c4c3)c2c1 |r|
CCN1Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)C3C[C@@]33C(=O)Nc4ccc(OC)cc34)cc2C1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(CCO)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(CC3)C3CCCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(CC3)C3CCCCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(OCCN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
Cc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cccnc5)n[nH]c4c3)c2c1 |r|
C[C@H]1CN(Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2)C[C@@H](C)O1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)c(F)c5)n[nH]c4c3)c2c1 |r|
Fc1cc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)ccc1CN1CCOCC1 |r|
C[C@H]1CCC[C@@H](C)N1Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3csc(CN4CCOCC4)c3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6[C@@H](C)CCC[C@H]6C)cc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(OCCN4CCOCC4)cc3)n[nH]c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CCN4CCOCC4)cc3)n[nH]c2c1 |r|
CCN(CC)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)cc1 |r|
Fc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(nc5)N5CCOCC5)n[nH]c4c3)c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(F)cc23)cc1 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC(F)F)cc12 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(F)cc12 |r|
CCN(CC)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)C2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
CCN(CC)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(nc5)N5CCOCC5)n[nH]c4c3)c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC(F)F)cc23)cc1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5cc(F)c(CN(C)C)c(F)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cc(F)c(CN(C)C)c(F)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5cc(F)c(CN6CCOCC6)c(F)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cc(F)c(CN6CCOCC6)c(F)c5)n[nH]c4c3)c2c1 |r|
Fc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
Fc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
CCN(CC)Cc1c(F)cc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)cc1F |r|
COc1ccc(cc1OC)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C(C)(C)C)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCCCO1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCCCC1)[C@H]1CNC(=O)C1 |r|
COc1cc(ccc1O)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCNCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCC(F)(F)CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cc2nn(C)cc2c(O[C@H](C)[C@@H]2CNC(=O)C2)n1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)[C@H]1CC[C@@H](CC1)N1CCN(C)C(=O)C1)[C@H]1CNC(=O)C1 |r,wU:32.36,1.0,21.27,wD:18.20,(2.24,5.88,;.9,6.65,;-.43,5.88,;-.43,4.34,;.9,3.57,;.9,2.03,;-.43,1.26,;-1.76,2.03,;-3.23,1.55,;-4.13,2.8,;-5.67,2.8,;-3.23,4.04,;-1.76,3.57,;2.24,1.26,;3.78,1.26,;4.25,-.21,;3.01,-1.11,;1.76,-.21,;3.01,-2.65,;1.67,-3.42,;1.67,-4.96,;3.01,-5.73,;4.34,-4.96,;4.34,-3.42,;3.01,-7.27,;1.67,-8.04,;1.67,-9.58,;3.01,-10.35,;3.01,-11.89,;4.34,-9.58,;5.67,-10.35,;4.34,-8.04,;.9,8.19,;-.34,9.09,;.13,10.56,;1.67,10.56,;2.44,11.89,;2.15,9.09,)|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cc2nn(C)cc2c(=O)[nH]1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccn(C)n1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(CCC(F)(F)F)c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1n[nH]c2ccc(cc12)C#N)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(Cn2ccnc2C)cc1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnn(c1)C(C)(C)C)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(cc1)N1CCOCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(cc1)N1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
CC(C)Oc1ccc(cn1)-c1cc(O[C@H](C)[C@H]2CNC(=O)C2)c2cn(C)nc2c1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc2n(C)ncc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cscn1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(N2CCN(C)CC2)c(c1)C(F)(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(cc1)N1CCCS1(=O)=O)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1csc(n1)C(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc2n(C)nc(N)c2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(N2CCOCC2)c(c1)C(F)(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnn(c1)C(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(F)cn1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccc(cc1)C1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnc2ccc(cn12)C#N)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnn(c1)C1CCNCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnn(c1)C1CCOCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cc2cccc(Cl)c2[nH]1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1cnn(c1)C1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(nc1)C1CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(nc1)C(F)F)[C@H]1CNC(=O)C1 |r|
COc1cc(cc(OC)c1OC)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
COc1ccc2[nH]cc(-c3cc4nn(C)cc4c(O[C@H](C)[C@H]4CNC(=O)C4)n3)c2c1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(C)s1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc2CCN(C)CCc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc2cc(C(=O)N(C)C)n(C)c2c1)[C@H]1CNC(=O)C1 |r|
COCCn1cc(cn1)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
CCn1cc(cn1)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
COc1ccc(cn1)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(cc1)C(F)(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(nc1)C(F)(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc2n(C)ncc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(C)c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCOCC1)[C@H]1CNC(=O)C1 |r|
CC(C)n1cc(cn1)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(nc1)N1CCOCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(cc1)N1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cn(C)nc1C)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(C)c1C)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)[C@H]1CCOC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(N2CCCS2(=O)=O)c(C)c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc2cnn(C)c2c1)[C@H]1CNC(=O)C1 |r|
COc1cc(ccc1OC1CCOCC1)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)[C@@H]1CCOC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc2CCN(C)Cc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cc2cccc(Cl)c2[nH]1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cn(nc1C)C1CCOCC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1ccc(cc1)C1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
COc1cc(ccc1OC(C)C)-c1cc2nn(C)cc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C1CCN(C)CC1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cn(cn1)C(F)F)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1cnn(C)c1C)[C@H]1CNC(=O)C1 |r|
CCCn1cc(cn1)-c1cc(O[C@H](C)[C@H]2CNC(=O)C2)c2cccnc2c1 |r|
CC(C)n1cc(cn1)-c1cc(O[C@H](C)[C@H]2CNC(=O)C2)c2cccnc2c1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2nc(C)sc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2n(C)cnc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2n(C)c(C)nc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2nc(C)nc(C)c2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2[nH]c(C)nc2c1)[C@H]1CNC(=O)C1 |r|
COc1cc(ccc1OC(F)(F)F)-c1cc2ncccc2c(O[C@H](C)[C@H]2CNC(=O)C2)n1 |r|
COc1cc(ccc1C(F)(F)F)-c1cc(O[C@H](C)[C@H]2CNC(=O)C2)c2cccnc2c1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccc2CCNCc2c1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2ncccc12)-c1ccccn1)[C@H]1CNC(=O)C1 |r|
Cc1cc(n[nH]1)-c1nc2cc3c(NC(=O)C3(C)C)cc2[nH]1
CCN1C(=O)C(C)(C)c2cc3nc([nH]c3cc12)-c1cc(C)[nH]n1
Cc1cc(n[nH]1)-c1cc2ccccc2[nH]1
Cc1[nH]nc-2c1Cc1c-2[nH]c2ccccc12
Cc1[nH]nc-2c1CCc1c-2[nH]c2ccccc12
Cc1[nH]nc-2c1CCCc1c-2[nH]c2ccccc12
CCN1C(=O)C(C)(C)c2cc3[nH]c4-c5n[nH]c(C)c5CCCc4c3cc12
Cc1[nH]nc-2c1CCCc1c-2[nH]c2cc3c(NC(=O)C3(C)C)cc12
Cc1[nH]nc-2c1CCCc1c-2[nH]c2cc3NC(=O)C(C)(C)c3cc12
CC(C)CCN1C(C)C(=O)N(C)c2cnc(Nc3cc(F)c(O)c(F)c3)nc12
COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4O)cc3)c2cc1OC
COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)c(O)c4)cc3)c2cc1OC
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)cc[n+]([O-])c2cc1OC
COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(O)=O)cc3)c2cc1OC
COc1cc2c(Nc3cc(CC(=O)Nc4ccccc4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4ccccc4F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4ccc(F)cc4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cc(F)cc(F)c4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(Cl)c4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(c4)C#N)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(c4)[N+]([O-])=O)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(O)c4)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cccc(NC(=O)Cc2cc(Nc3ncnc4cc(OCCCN5CCC(CO)CC5)c(OC)cc34)[nH]n2)c1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(c4)C(F)(F)F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCC[C@@H]1CO |r|
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCC[C@H]1CO |r|
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCN(CCO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCC(O)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN1CCC(CCO)CC1
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2cc1OCCCN1CCC[C@@H]1CO |r|
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2cc1OCCCNCCO
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2cc1OCCCN(C)CCO
CCN(CCO)CCCOc1cc2ncnc(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)c2cc1OC
CCCN(CCO)CCCOc1cc2ncnc(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)c2cc1OC
CCN(CCO)CCCOc1cc2ncnc(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)c2cc1OC
CCCN(CCO)CCCOc1cc2ncnc(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)c2cc1OC
COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2cc1OCCCN(CCO)CC(C)C
CCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2c1
CCCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2c1
OC[C@H]1CCCN1CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4F)n[nH]3)ncnc2c1 |r|
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
CCCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1
OC[C@H]1CCCN1CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1 |r|
COc1cc2c(Nc3cnn(CC(=O)Nc4cccc(F)c4F)c3)ncnc2cc1OCCCN1CCC[C@@H]1CO |r|
CCN(CCO)CCCOc1cc2ncnc(Nc3cnn(CC(=O)Nc4cccc(F)c4F)c3)c2cc1OC
COc1cc2c(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)ncnc2cc1OCCCN1CCC[C@@H]1CO |r|
CCN(CCO)CCCOc1cc2ncnc(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)c2cc1OC
OC[C@H]1CCCN1CCCOc1ccc2c(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)ncnc2c1 |r|
OC[C@H]1CCCN1CCCOc1ccc2c(Nc3cnn(CC(=O)Nc4cccc(F)c4F)c3)ncnc2c1 |r|
c1cc(cc(c1)NC(=O)Nc2ncc(s2)CCNc3c4c(ccs4)ncn3)C(F)(F)F
FC(F)(F)c1cccc(CC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)c1
FC(F)(F)c1cccc(NC(=O)Cc2ncc(CCNc3ncnc4ccsc34)s2)c1
O=C(Nc1ncc(CCNc2ncnc3ccsc23)s1)Nc1ccccc1
Cc1cccc(NC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)c1
Fc1cccc(NC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)c1
c1cc(cc(c1)Cl)NC(=O)Nc2ncc(s2)CCNc3c4c(ccs4)ncn3
Clc1ccc(NC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)cc1Cl
Fc1ccc(NC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)cc1Cl
O=C(Nc1ncc(CCNc2ncnc3ccsc23)s1)Nc1cccc2cc[nH]c12
O=C(NC1CCCCC1)Nc1ncc(CCNc2ncnc3ccsc23)s1
FC(F)(F)c1cc(CN2CCCC2)cc(NC(=O)Nc2ncc(CCNc3ncnc4ccsc34)s2)c1
O=C(Nc1ncc(CCNc2ncnc3ccsc23)s1)Nc1cccc(CCN2CCC2)c1
CCOC(=O)N1CC2CC(CC2C1)Nc1nc(Nc2cnn(C)c2)ncc1Cl
CCNC(=O)N1CC2CC(CC2C1)Nc1nc(Nc2cnn(C)c2)ncc1Cl
Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)C(=O)NC3CC3)n2)cn1
CCNS(=O)(=O)N1CC2CC(CC2C1)Nc1nc(Nc2cnn(C)c2)ncc1Cl
Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(=O)(=O)NC3CC3)n2)cn1
CC(O)Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(C)(=O)=O)n2)cn1
CC(C)(O)Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(C)(=O)=O)n2)cn1
CC(O)Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(=O)(=O)C3CC3)n2)cn1
CCNS(=O)(=O)N1CC2CC(CC2C1)Nc1nc(Nc2cnn(CC(C)O)c2)ncc1Cl
CC(O)Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(=O)(=O)CC3CC3)n2)cn1
CC(O)Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(=O)(=O)NC3CC3)n2)cn1
c1cc(n[nH]1)-c1nc2ccccc2[nH]1
CC(=O)Nc1c[nH]nc1-c1nc2ccccc2[nH]1
O=C(Nc1c[nH]nc1-c1nc2ccccc2[nH]1)c1ccccc1
O=C(Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)c1ccccc1
Fc1ccc(cc1)C(=O)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
O=C(Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)Nc1ccccc1
Fc1ccccc1NC(=O)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
Fc1cccc(F)c1NC(=O)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
O=C(NC1CCCCC1)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
O=C(Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)Nc1cccnc1
O=C(NC1CCOCC1)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
O=C(NC1CC1)Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
[H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
c1ccc(c(c1)C(=O)Nc2ccc(cc2)Nc3c(cnc(n3)Nc4ccc(cc4)O)F)Cl
Oc1ccc(Nc2ncc(F)c(Nc3ccc(cc3)C(=O)Nc3ccccc3Cl)n2)cc1
Oc1ccc(Nc2ncc(F)c(Nc3ccc(cc3)C(=O)NC3CC3)n2)cc1
CC(=O)N1CCN(CC1)C(=O)Cc2ccc(cc2)Nc3ncc(c(n3)Nc4ccc(cc4)C(=O)Nc5ccccc5Cl)F
CCN1CCN(CC1)C(=O)Cc1ccc(Nc2ncc(F)c(Nc3ccc(cc3)C(=O)Nc3ccccc3Cl)n2)cc1
CN1c2ccccc2C(=O)N(c3c1nc(nc3)Nc4ccc(cc4)N5CCC(CC5)O)C
CC(C)Nc1nc(nc2ccc(C=CC(C)(C)O)cc12)-c1ccco1
OCC=Cc1ccc2ncnc(Nc3cccc(F)c3)c2c1
CC(C)Nc1nc(nc2ccc(cc12)C#CCO)-c1ccco1
COC1CN(C)CCN1c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(cc3)S(=O)(=O)N3CCC(O)CC3)nc12
CC1CCN(CC1)S(=O)(=O)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
CCN1CCN(CC1)C(=O)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1
CCN1CCN(CC1)C(=O)Cc1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(OCc4ccccn4)cc3)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(OCc4cccc(F)c4)cc3)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(OCc4cccc(Cl)c4)cc3)nc12
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1C(F)(F)F
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(OCc4ccccn4)c(Cl)c3)nc12
CN1CCN(CC1)C(=O)c1cccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)c1
CN1CCN(Cc2cccc(Nc3ncc4N(C)C(=O)c5ccccc5N(C)c4n3)c2)CC1
CN1CCN(CC1)c1cccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)c1
CN1c2ccccc2C(=O)Nc2cnc(Nc3ccc(cc3)N3CCC(O)CC3)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(C(=O)N4CCC(O)CC4)c(c3)C(F)(F)F)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(C(=O)N4CCC(O)CC4)c(Cl)c3)nc12
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)cc1C
COc1cc(Nc2ncc3N(C)C(=O)c4ccccc4N(C)c3n2)ccc1C(=O)N1CCN(O)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccccc5N(C)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccccc5N(C(C)C)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccccc5N(C5CCCC5)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccccc5Oc4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccccc5Sc4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5cccc(C)c5N(C)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5cccc(F)c5N(C)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccc(C)cc5N(C)c4n3)cc2C(F)(F)F)CC1
CCN1CCN(Cc2ccc(Nc3ncc4N(C)C(=O)c5ccc(F)cc5N(C)c4n3)cc2C(F)(F)F)CC1
CCN(CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1)CCOP(O)(O)=O
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Clc1ccccc1Nc1ccnc(Nc2ccc(cc2)C(=O)NCCN2CCOCC2)n1
CN(C)CCNC(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
COCCNC(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
CS(=O)(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
CC(=O)Nc1cccc(Nc2nccc(Nc3ccccc3Cl)n2)c1
Clc1ccccc1Nc1ccnc(Nc2ccc3[nH]c(=O)[nH]c3c2)n1
COc1cc(Nc2nccc(Nc3ccccc3Cl)n2)ccc1C(O)=O
Clc1ccccc1Nc1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
NC(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
NS(=O)(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
Fc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1Nc1ccccc1Cl
Fc1cnc(Nc2ccc(CN3CCOCC3)cc2)nc1Nc1ccccc1Cl
OCCNC(=O)c1ccc(Nc2nccc(Nc3ccccc3Cl)n2)cc1
NC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3Cl)n2)cc1
NS(=O)(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3Cl)n2)cc1
Clc1ccccc1Nc1ccnc(Nc2ccc(cc2)-c2nnn[nH]2)n1
Fc1cnc(Nc2ccc(cc2)-c2nnn[nH]2)nc1Nc1ccccc1Cl
Clc1ccccc1Nc1nc(Nc2ccc(cc2)-c2nnn[nH]2)ncc1Cl
Cc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)ccc23)cc1Nc1ncc(cn1)-c1cccnc1
Cc1ccc(Nc2ncnc3cc(OCCCN4CCCCC4)ccc23)cc1Nc1ncc(cn1)-c1cccnc1
CCN(CC)CCCOc1ccc2c(Nc3ccc(C)c(Nc4ncc(cn4)-c4cccnc4)c3)ncnc2c1
Cc1ccc(Nc2ncnc3cc(OCCCN4CCCC4)ccc23)cc1Nc1ncc(cn1)-c1cccnc1
CCOC(=O)c1csc2cc(Nc3ncnc4cc(OCCCN5CCN(C)CC5)ccc34)ccc12
CCOC(=O)c1csc2cc(Nc3ncnc4cc(OCCCN5CCCC5)ccc34)ccc12
CCOC(=O)c1csc2cc(Nc3ncnc4cc(OCCCN(CC)CC)ccc34)ccc12
COc1cc(CNc2cncc3c(cccc23)C(N)=O)cc(OC)c1
NC(=O)c1cccc2c(NCc3ccco3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Nc4ccccc4F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Nc4ccccc4Cl)c3)ncnc12
COc1ccccc1NC(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Nc4cccc(F)c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cc(F)cc(F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)NC(=O)c4ccccc4)c3)ncnc12
C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1cccc2ccccc12 |r|
NC(=O)c1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CNC(=O)c1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(N[C@H]3CCCc4ccccc34)ncnc12 |r|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Nc4ccccc4C(F)(F)F)c3)ncnc12
Cc1cccc(NC(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c1
NC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1 |r|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)N4CCCCC4)c3)ncnc12
NC(=O)c1cccc2c(NCCNCc3ccccc3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Br)cc4)c3)ncnc12
CN(C)c1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc5OCOc5c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Cc4ccccc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(F)c(F)c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(SC(F)(F)F)cc4)c3)ncnc12
COc1cc(C(N)=O)c2ncnc(NCc3cccc(NC(=O)c4ccc(F)cc4)c3)c2c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Cc4ccc(Cl)cc4)c3)ncnc12
CCOc1cc(C(N)=O)c2ncnc(NCc3cccc(NC(=O)c4ccc(F)cc4)c3)c2c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Cl)nc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(Cl)n4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(OCCN(CCO)CCO)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccnc(Cl)c4)c3)ncnc12
NC(=O)c1cc(OCc2ccccc2)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
CN(C)c1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CN(C)c1cccc(n1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CN(C)c1cc(ccn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cc(O)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
COCCN(C)CCCOc1cc(C(N)=O)c2ncnc(NCc3ccc(cc3)C(F)(F)F)c2c1
NC(=O)c1cc(OCCCN2CCN(CCO)CC2)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
NC(=O)c1cc(OCCCN2CCOCC2)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
NC(=O)c1cc(OCCCN2CCC(O)C2)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
NC(=O)c1cc(OCCCN2CCC[C@H]2CO)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12 |r|
CN1CCN(CCCOc2cc(C(N)=O)c3ncnc(NCc4ccc(cc4)C(F)(F)F)c3c2)CC1
NC(=O)c1cc(OCCCNCCO)cc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
COCCCOc1cc(C(N)=O)c2ncnc(NCc3ccc(cc3)C(F)(F)F)c2c1
COc1ccccc1C(CN)Nc1ncnc2c(cccc12)C(N)=O
COc1ccccc1C(CNC(C)=O)Nc1ncnc2c(cccc12)C(N)=O
NC(=O)c1cccc2c(NCc3cccc(F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc4ccccc34)ncnc12
NC(=O)c1cccc2c(NCc3ccc(F)cc3F)ncnc12
NC(=O)c1cccc2c(NCc3ccccc3C(F)(F)F)ncnc12
NC(=O)c1cccc2c(NCc3ccc4OCOc4c3)ncnc12
NC(=O)c1cccc2c(NCc3ccc(cc3)C(F)(F)F)ncnc12
NC(=O)c1cccc2c(NCc3cccc(O)c3)ncnc12
NC(=O)c1cccc2c(NCc3ccc(Cl)c(c3)C(F)(F)F)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(F)cc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)Nc4ccccc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(c3)C(F)(F)F)ccnc12
C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1 |r|
NC(=O)c1cc(N)cc2c(NCc3ccc(Cl)c(c3)C(F)(F)F)ncnc12
NC(=O)c1cc(NC(=O)c2ccncc2)cc2c(NCc3ccc(Cl)c(c3)C(F)(F)F)ncnc12
CN(C)CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccnc(c2)N2CCCC2)c1
COc1ccc(cc1F)C(=O)Nc1cccc(c1)C(CN(C)C)Nc1ncnc2=C(CCC=c12)C(N)=O |t:30,34|
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc3OCOc3c2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(F)cc4F)c3)ncnc12
CN(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1 |r|
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(F)c(O)c2)c1
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(F)cc2F)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Cl)cc4Cl)c3)ncnc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(cc2)C(F)(F)F)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cncc(c4)N4CCCC4)c3)ncnc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2cc(n[nH]2)C(C)(C)C)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2=CCC(Br)C=C2)c1 |c:31,t:26|
NCC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1 |r|
COCCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(cc2)C(F)(F)F)c1
CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(nc2)C(F)(F)F)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(Cl)c(F)c2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2=CCC(Cl)N=C2)c1 |c:31,t:26|
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(C)nc2)c1
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)C1=CCCC(NC(=O)c2cccc(F)c2F)=C1 |c:38,t:22|
NC(=O)c1cccc2c(NCc3ccc(F)c(NC(=O)c4ccc(Br)cc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)C4=CC(F)C(Cl)C=C4)c3)ncnc12 |c:25,t:19|
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(CCN(C)CC=C)Nc1ncnc2c(cccc12)C(N)=O
NC(=O)c1cccc2c(NC(CCN3CCC3)c3cccc(NC(=O)c4ccc(Br)cc4)c3)ncnc12
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc3OCCOc3c2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(O)c4cc(ccc4F)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cncc(c4)N4CCOCC4)c3)ncnc12
COCCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(F)c(F)c2)c1
CN(CCO)c1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccccc2)c1
NC(=O)C1=c2ncnc(NC(CCN3CCCC3)c3cccc(NC(=O)c4ccc(Br)cc4)c3)c2=CCC1 |c:3,38|
COc1ccc(C(=O)NC2=CC(=CCC2)C(CCN(C)C)Nc2ncnc3c(cccc23)C(N)=O)c(F)c1 |c:11,t:9|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccnc(c4)N4CCCC4)c3)ncnc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)C1=CCCC(NC(=O)c2ccccc2F)=C1 |c:37,t:22|
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(OC(F)(F)F)cc2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Cl)c(Cl)c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(OCCCO)c4)c3)ncnc12
COCCN(C)c1cc(ccn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc5OCCc5c4)c3)ncnc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)C1=CCCC(NC(=O)c2c(F)cccc2F)=C1 |c:38,t:22|
CC(C)c1cc([nH]n1)C(=O)Nc1cccc(c1)C(C)Nc1ncnc2c(cccc12)C(N)=O
CCn1nc(cc1C(=O)Nc1cccc(c1)C(C)Nc1ncnc2c(cccc12)C(N)=O)C(F)(F)F
COc1ccc(cc1C)C(O)N=C1CC(CNc2ncnc3c(cccc23)C(N)=O)CC=C1 |w:11.11,c:34|
COc1cc(ccn1)C(=O)NC1=CCCC(=C1)C(C)Nc1ncnc2c(cccc12)C(N)=O |c:16,t:12|
CN1CCN(CC1)c1ccc(NC(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)cc1
COc1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
COc1ccc(cc1F)C(=O)Nc1cccc(c1)C(C)Nc1ncnc2c(cccc12)C(N)=O
CCN(CC)c1ccc(cc1)C(=O)Nc1cccc(c1)C(C)Nc1ncnc2c(cccc12)C(N)=O
COCCCOC1CC=CC(=C1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1 |c:8,10|
CNCCOc1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cc(n[nH]4)C(F)(F)F)c3)ncnc12
Cn1cnc2c(Nc3cccc(CNc4ncnc5c(cccc45)C(N)=O)c3)nccc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2cc(F)ccc2F)c1
COc1ccc(cc1F)C(=O)Nc1cccc(c1)[C@@H](C)Nc1ncnc2c(cccc12)C(N)=O |r|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccnc(c4)N4CCCCC4)c3)ncnc12
NC(=O)c1cccc2c(NCC3CC(NC=O)=CC=C3)ncnc12 |c:16,18|
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(O)c2cc(n[nH]2)C2CC2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2cc(C)oc2C(F)(F)F)c1
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(CCN(C)C)Nc1ncnc2c(cccc12)C(N)=O
COCCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(OC(F)(F)F)cc2)c1
CCOc1cc(ccn1)C(=O)Nc1cccc(c1)C(C)Nc1ncnc2c(cccc12)C(N)=O
CS(=O)(=O)c1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CN(C)CCOc1ccc(NC(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)cc1
CN1CCN(CC1)c1ccc(cc1C(F)(F)F)C(=O)Nc1cccc(CNc2nncc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccnc(NCCO)c4)c3)ncnc12
COCCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(OC)cc2)c1
CNc1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NC(CCN3CCCCC3)c3cccc(NC(=O)c4ccc(Br)cc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3ccc(NC(=O)c4cc(n[nH]4)C(F)(F)F)cc3)ncnc12
COc1ccc(C(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c(OC)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(CN5CCCC5)cc4)c3)ncnc12
NC(=O)c1cccc2c(N[C@H](CN3CCCC3)c3ccccc3)ncnc12 |r|
COc1ccc(cc1F)C(=O)Nc1cccc(CNc2ccnc3c(cccc23)C(N)=O)c1
COCCNc1cc(ccn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)C1=c2ncnc(NC(CCN3CCCC3)c3cccc(NC(=O)c4ccccc4)c3)c2=CCC1 |c:3,37|
COc1ccc(cc1C(F)(F)F)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
COc1ccc(cc1F)C(=O)NC1=CCCC(=C1)[C@H](C)Nc1ncnc2c(cccc12)C(N)=O |r,c:17,t:13|
NC(=O)c1cccc2c(NCc3cccc(Nc4ccccn4)c3)ncnc12
CCOC(=O)c1cnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)s1
NC(=O)c1cccc2c(NCc3cccc(Nc4nccs4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cn[nH]c4N)c3)ncnc12
COCC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(OC)cc2)c1 |r|
NCc1cnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)s1
NC(=O)c1cccc2c(NCc3cccc(Nc4cc(ccn4)C#N)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4[nH]nc5CCCCc45)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(cc4)-c4ncc[nH]4)c3)ncnc12
Cc1cc(ccc1N1CCOCC1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(CO)cc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(CO)cc4)c3)ncnc12
Cc1ccnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2CC(F)(F)C2)c1
NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(CC#N)cn4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc5nc[nH]c5c4)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(cc23)C(O)CO)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(N5CCOCC5)c(c4)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(cc4)N4CCCCC4=O)c3)ncnc12
CC(Nc1ncnc2c(cccc12)C(N)=O)C1=CC(NC(=O)C2(CCC2)C(F)(F)F)=CCC1 |c:32,t:18|
Cc1nc(no1)-c1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2CC(F)(F)C2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C(F)(F)C(F)(F)F)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(c4)N4CCOCC4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(Nc4cc(CC#N)ccn4)c3)ncnc12
COc1ccc2nc(Nc3cccc(CNc4ncnc5c(cccc45)C(N)=O)c3)sc2c1
NC(=O)c1cccc2c(NCc3cccc(Nc4nc5ccccc5s4)c3)ncnc12
CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2CC2(F)F)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(=O)[nH]c2)c1
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)CC(F)(F)F)c1
NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(cn4)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(Nc3cccc(CNC(=O)c4ccc(cc4)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(NCC3CC=CC(C3)=NC(O)c3c[nH]c4ncccc34)ncnc12 |w:17.18,c:13|
NC(=O)c1cccc2c(NCC3CC=CC(NC(=O)c4ccncc4)=C3)ncnc12 |c:13,25|
COCCOc1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CN(C)CCCOC1CC=C(C=C1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1 |c:9,11|
COCCOc1ccccc1C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cnn5CCNCc45)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1ccc(C)c(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(Nc4ncccn4)c3)ncnc12
NC(=O)c1cccc2c(Nc3cccc(CNC(=O)c4cccnc4)c3)ncnc12
NC(=O)c1cccc2c(NC(CCN3CCCCC3)c3cccc(Nc4ccccn4)c3)ncnc12
Cc1cc(nn1CC(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1)C(F)(F)F
COc1ccc(cc1)C(=O)Nc1ccc2CCN(Cc2c1)c1ncnc2c(cccc12)C(N)=O
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4n[nH]c5ccc(Cl)cc45)c3)ncnc12
CC(N)c1cccc(NC(=O)c2ccoc2CN2CCOCC2)c1
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(CN4CCOCC4)cc23)C(N)=O)c1
NC(=O)c1cccc2c(NC(CCN3CCCC3)c3cccc(Nc4ccccn4)c3)ncnc12
CC(C)N1CCC(CC1)C(=O)Nc1cccc(CNC2=NC=NC3C(=CCC=C23)C(N)=O)c1 |c:22,25,t:20,28|
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)C2CNC(=O)C2)c1
COc1ccc(cc1)C(=O)Nc1cccc(CNc2c(cnc3c(cccc23)C(N)=O)C(N)=O)c1
NC(=O)c1cccc2c(Nc3cccc(CNC(=O)C4CCCNC4)c3)ncnc12
CCN(CC)CCOC1CC=C(C=C1)C(O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1 |c:10,12|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4n[nH]c5ccc(Br)cc45)c3)ncnc12
COC1CC=C(C=C1)C(=O)Nc1cccc(CNc2ncnc3=C(CC(CN4CCN(C)CC4)C=c23)C(N)=O)c1 |c:4,6,t:23,36|
COc1ccc(cc1)C(=O)NCc1cccc(Nc2ncnc3c(cc(O)cc23)C(N)=O)c1
CC(C)c1cc([nH]n1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CNc1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CCN(CC)CCOc1cc(C(N)=O)c2ncnc(NCc3cccc(NC(=O)c4ccc(OC)cc4)c3)c2c1
Cc1cc([nH]n1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
Cc1ccccc1C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
CN(C)c1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3=C(CCC=c23)C(N)=O)c1 |t:24,28|
Cc1cccc(c1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
COCCOc1cc(C(N)=O)c2ncnc(NCc3cccc(NC(=O)c4ccc(OC)cc4)c3)c2c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(cc4F)C(F)(F)F)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(CCCCO)cc23)C(N)=O)c1
CCOc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)C4CCCCC4)c3)ncnc12
CC(=O)Nc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc5OC(F)(F)Oc5c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(nc4)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(Br)c4)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(Cl)c4)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(CN(C)c2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)C4CCCNC4)c3)ncnc12
CN(C)CCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccccc2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)C4=CCC(C=C4)N4CCOCC4)c3)ncnc12 |c:23,t:19|
COc1ccc(cc1OC)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cccc(OC(F)(F)F)c4)c3)ncnc12
COc1ccccc1C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(cc4)C#N)c3)ncnc12
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Cl)cc4)c3)ncnc12
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(O)c(F)c2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccccc4OCCO)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1ccc(F)c(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4c(F)cccc4F)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cc(CNc2ncnc3c(cccc23)C(N)=O)ccc1C
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(CN(C)C)cc2)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccccc4C#N)c3)ncnc12
CN1CCN(Cc2ccc(cc2)C(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)CC1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(Cl)c(c4)C(F)(F)F)c3)ncnc12
CN1CCN(CC1)c1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
COCC[C@H](Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(OC)cc2)c1 |r|
NC(=O)c1cccc2c(NCc3cccc(Nc4nc5ccc(cc5[nH]4)C(F)(F)F)c3)ncnc12
NC(=O)c1cccc2c(NCC3CC=CC(C3)=NC(O)c3ccn[nH]3)ncnc12 |w:17.18,c:13|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4cc(n[nH]4)C4CC4)c3)ncnc12
COc1cccc(OC)c1C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccccc4F)c3)ncnc12
CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(NC(=O)c2ccc(CN3CCCC3)cc2)c1
NC(=O)c1cccc2c(NC(CCN3CCCCC3)c3cccc(NC(O)c4ccccc4)c3)ncnc12
NC(=O)c1cccc2c(NCc3ccc(F)c(NC(=O)c4ccc(OC(F)(F)F)cc4)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(CCN1CCCC1)Nc1ncnc2c(cccc12)C(N)=O
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(CCN1CCC1)Nc1ncnc2c(cccc12)C(N)=O
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccc(nc4)N4CCCCC4)c3)ncnc12
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(CCN1CCCCC1)Nc1ncnc2c(cccc12)C(N)=O
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(OCCCN(C)C)cc23)C(N)=O)c1
NC(=O)c1cc(OCc2ccccc2)cc2c(NCc3cccc(NC(=O)c4ccnc(c4)N4CCCC4)c3)ncnc12
COc1cc(F)c(C(=O)Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c(F)c1
COc1ccc(cc1)C(=O)Nc1cccc(CNc2ncnc3c(cc(O)cc23)C(N)=O)c1
NC(=O)C1=c2ncnc(NCc3cccc(NC(=O)c4ccc(cc4)C(F)(F)F)c3)c2=CCC1 |c:3,33|
NC(=O)c1cccc2c(NCc3cccc(NC(=O)c4ccccc4C(F)(F)F)c3)ncnc12
CC(C)n1cc(cn1)-c1cc(C(N)=O)c2ncnc(N[C@H]3CCCNC3)c2c1 |r|
NC(=O)C1CC=C(C=C1)c1cc(C(N)=O)c2ncnc(N[C@H]3CCCNC3)c2c1 |r,c:5,7|
NC(=O)c1cccc(c1)-c1cc(C(N)=O)c2ncnc(N[C@H]3CCCNC3)c2c1 |r|
Nc1ncc(-c2cnn(CCO)c2)c2scc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
C[C@H](O)Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
COc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(CC(C)(C)O)c2)cc1
COc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(C[C@H](O)CO)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cn[nH]c2)c1
COc1cc(cc(OC)c1OC)-c1cc(=O)c2c(O)c(OC)c(OC)c(OC)c2o1
c1cc(ccc1C2=CC(=O)c3c(cc(cc3O2)O)O)O
COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1
c1cc(c(cc1C2=C(C(=O)c3c(cc(c(c3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O)O
OC[C@H]1O[C@@H](Oc2ccc(cc2O)-c2oc3cc(O)cc(O)c3c(=O)c2O)[C@H](O)[C@@H](O)[C@@H]1O
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
COc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
c1ccc(cc1)C2=CC(=O)c3c(cc(c(c3O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O2
c1ccc(cc1)C2=CC(=O)c3c(cc(c(c3O)O)O)O2
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O
Oc1c(oc2ccccc2c1=O)-c1ccccc1
COc1cc(ccc1O)-c1oc2cc(O)ccc2c(=O)c1O
c1cc(c(cc1C2=C(C(=O)c3ccc(cc3O2)O)O)O)O
c1ccc(cc1)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
c1ccc(c(c1)C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
COc1cc(ccc1O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
c1cc(c(cc1O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
c1c(cc(c(c1O)O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
COc1ccc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O
Oc1ccc(cc1O)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O
c1cc(c(cc1C2=C(C(=O)c3c(cc(c(c3O)O)O)O2)O)O)O
COc1ccc(cc1O)C2=CC(=O)c3c(cc(cc3O2)O)O
COc1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)cc2o1
c1cc(c(cc1C2=CC(=O)c3c(cc(cc3O2)O)O)O)O
Oc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1
COc1cc(Nc2ncc3CN=C(c4c(F)cccc4OC)c4c(Cl)cccc4-c3n2)ccc1C(O)=O |t:11|
CN1CCN(CC1)c2ccc(c(c2)NC3CCOCC3)C(=O)Nc4c5cc(ccc5[nH]n4)Cc6cc(cc(c6)F)F
CN1CCN(CC1)c1ccc(cc1)C(=O)Nc1n[nH]c2ccc(Cc3cc(F)cc(F)c3)cc12
COCCNc1cc(ccc1C(=O)Nc1n[nH]c2ccc(Cc3cc(F)cc(F)c3)cc12)N1CCN(C)CC1
CN1CCN(CC1)c1ccc(C(=O)Nc2n[nH]c3ccc(Cc4cc(F)cc(F)c4)cc23)c(NC2CCCCC2)c1
CC1(C)CN(CCN1)c1ccc(cc1)-c1oc(nc1C(N)=O)-c1c(F)ccc2[nH]ccc12
Cc1ccc2[nH]ccc2c1-c1nc(C(N)=O)c(o1)-c1ccc(cc1)N1CCNC(C)(C)C1
CC1(C)CN(CCN1)c1ccc(cc1)-c1oc(nc1C(N)=O)-c1ccc(F)c2[nH]ccc12
CC1(C)CN(CCN1)c1ccc(cc1)-c1oc(nc1C(N)=O)-c1ccc(Cl)c2[nH]ccc12
COc1ccc(-c2nc(C(N)=O)c(o2)-c2ccc(cc2)N2CCNC(C)(C)C2)c2cc[nH]c12
Cc1cc(C)c2[nH]ccc2c1-c1nc(C(N)=O)c(o1)-c1ccc(cc1)N1CCNC(C)(C)C1
Cc1cc(F)c2[nH]ccc2c1-c1nc(C(N)=O)c(o1)-c1ccc(cc1)N1CCNC(C)(C)C1
Cc1c[nH]c2cccc(-c3nc(C(N)=O)c(o3)-c3ccc(cc3)N3CCNC(C)(C)C3)c12
CCc1ccc(-c2nc(C(N)=O)c(o2)-c2ccc(cc2)N2CCNC(C)(C)C2)c2cc[nH]c12
CC1(C)CN(CCN1)c1ccc(cc1)-c1oc(nc1C(N)=O)-c1cccc2[nH]ccc12
CC1(C)CN(CCN1)c1ccc(cc1)-c1oc(nc1C(N)=O)-c1ccc(c2[nH]ccc12)C(F)(F)F
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
N[C@H]1CCCC[C@H]1Nc1nnc(C(N)=O)c(Nc2ccc3cn(nc3c2)C(F)F)n1 |r|
N[C@H]1COCC[C@H]1Nc1nnc(C(N)=O)c(Nc2cccc3n(ccc23)C2CC2)n1 |r|
N[C@H]1CCCC[C@H]1Nc1nnc(C(N)=O)c(Nc2cc3ccccc3s2)n1 |r|
CCOC(=O)C1=C(NC(=C([C@H]1c2cccc(c2Cl)Cl)C(=O)OC)C)C
Cc1cc(O)cc(O)c1\N=N\c1nccs1
Cn1cc(Nc2ncc(Cl)c(NC3COC4C(COC34)OCCO)n2)cn1
Cn1cc(Nc2ncc(Cl)c(NC3COC4C(COC34)NS(C)(=O)=O)n2)cn1
c1c(cc(c(c1F)COc2c(c(sn2)NC(=O)NCCCCN3CCCC3)C(=O)N)F)Br
Cc1nn(C)cc1-c1nc2c(N3CCN(Cc4ccc(Cl)cc4)CC3)c(Cl)cnc2[nH]1
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2cn[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12 |r|
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(Br)cc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCOCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCNCC3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccncc3)n[nH]c2c1 |r|
CN(C)Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@H]2C[C@@]22C(=O)Nc3ccccc23)cc1 |r|
Brc1cnc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5cccnc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(nc5)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccnc(c3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
Fc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(I)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3cccc(CO)c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3ccc(CN4CCCCC4)cc3)n[nH]c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN6CCCCC6)nc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3ccc(CN4CCCCC4)nc3)n[nH]c2c1 |r|
CN1CCN(CC1)c1ccc(cc1)-c1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(N)cc12 |r|
CN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(cc4)N4CCNCC4)n[nH]c3c2)c2ccccc12 |r|
O=C1Nc2ccccc2[C@]11CC1c1ccc2c(\C=C\c3ccc(cc3)N3CCNCC3)n[nH]c2c1 |r|
CN1C(=O)[C@@]2(CC2c2ccc3c(n[nH]c3c2)-c2ccc(nc2)N2CCN(C)CC2)c2ccccc12 |r|
CN1C(=O)[C@@]2(CC2c2ccc3c(\C=C\c4ccc(CN5CCCCC5)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(CC3)C(C)C)c2c1 |r|
CCN1CCN(CC1)c1ccc(cc1)-c1n[nH]c2cc(ccc12)C1C[C@@]11C(=O)Nc2ccc(OC)cc12 |r|
COc1ccc2N(C)C(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(OCCN(C)C)cc3)c2c1 |r|
COc1ccc2N(C)C(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1 |r|
F[C@@H]1CCN(Cc2ccc(\C=C\C3NNc4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccccc34)cc2)C1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCC(O)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCC(CC3)N(C)C)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)C3CCNCC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)C#Cc3ccc(C=O)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)C#Cc3ccc(CN4CCOCC4)cc3)c2c1 |r|
CCc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(cc3)N3CCN(C)CC3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)C#Cc3ccc(CN4CCN(C)CC4)cc3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1 |r|
CN1CCN(Cc2ccc(cc2)-c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)CC1 |r|
Cc1ccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)c(C)n1 |r|
CN(C)Cc1cccc(\C=C\c2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccccc23)c1 |r|
NC(=O)CN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(CN5CCCCC5)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(n[nH]c4c3)-c3ccc(CN(C)C)cc3)c2c1 |r|
CCc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2c1 |r|
COc1cc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN(C)C)cc5)n[nH]c4c3)c2cc1OC |r|
CC(C)CCN1C(=O)[C@@]2(C[C@H]2c2ccc3c(\C=C\c4ccc(CN(C)C)cc4)n[nH]c3c2)c2ccccc12 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(cc5)C(=O)N5CCN(C)CC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5csc(CN(C)C)c5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(cc5)N5CCNCC5)n[nH]c4c3)c2c1 |r|
CCN1Cc2ccc(\C=C\c3n[nH]c4cc(ccc34)[C@@H]3C[C@@]33C(=O)Nc4ccc(OC)cc34)cc2C1 |r|
Cc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(CN6CCOCC6)cc5)n[nH]c4c3)c2c1 |r|
O=C1Nc2ccccc2[C@]11C[C@H]1c1ccc2c(\C=C\c3ccc(CCN4CCCOC4)cc3)n[nH]c2c1 |r|
Fc1ccc2NC(=O)[C@@]3(CC3c3ccc4c(\C=C\c5ccc(nc5)N5CCOCC5)n[nH]c4c3)c2c1 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(nc5)N5CCOCC5)n[nH]c4c3)c2c1 |r|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:23.25,wD:20.21,(-.77,3.78,;-2.1,3.01,;-3.44,3.78,;-4.77,3.01,;-6.24,3.49,;-7.14,2.24,;-6.24,1,;-4.77,1.47,;-3.44,.7,;-2.1,1.47,;-.77,.7,;.56,1.47,;.56,3.01,;1.9,3.78,;3.23,3.01,;4.7,3.49,;5.17,4.95,;5.6,2.24,;7.14,2.24,;4.7,1,;5.09,-.49,;4.01,-1.58,;4.4,-3.07,;5.89,-3.47,;6.29,-4.95,;6.98,-2.38,;6.58,-.89,;3.23,1.47,;1.9,.7,)|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CC[C@H](O)CC3)c2n1 |r,wU:20.21,23.25,(-.77,3.78,;-2.1,3.01,;-3.44,3.78,;-4.77,3.01,;-6.24,3.49,;-7.14,2.24,;-6.24,1,;-4.77,1.47,;-3.44,.7,;-2.1,1.47,;-.77,.7,;.56,1.47,;.56,3.01,;1.9,3.78,;3.23,3.01,;4.7,3.49,;5.17,4.95,;5.6,2.24,;7.14,2.24,;4.7,1,;5.09,-.49,;4.01,-1.58,;4.4,-3.07,;5.89,-3.47,;6.29,-4.95,;6.98,-2.38,;6.58,-.89,;3.23,1.47,;1.9,.7,)|
Cc1cc2ncnn2cc1Nc3ncc4c(n3)N(C(=O)N4C)C5CCOCC5
Cc1nc2cc(C)c(Nc3ncc4n(C)c(=O)n(C5CCOCC5)c4n3)cn2n1
CO[C@H]1CC[C@H](CC1)n1c2nc(Nc3cn4ncnc4cc3C)ncc2n(C)c1=O |r,wU:5.8,2.1,(7.49,-4.96,;5.95,-4.96,;5.55,-3.48,;4.06,-3.08,;3.66,-1.59,;4.75,-.5,;6.24,-.9,;6.64,-2.39,;4.35,.99,;2.89,1.46,;1.55,.69,;.22,1.46,;-1.11,.69,;-2.45,1.46,;-3.78,.69,;-5.12,1.46,;-6.58,.99,;-7.49,2.23,;-6.58,3.48,;-5.12,3,;-3.78,3.77,;-2.45,3,;-1.11,3.77,;.22,3,;1.55,3.77,;2.89,3,;4.35,3.48,;4.75,4.96,;5.26,2.23,;6.8,2.23,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(Nc3cn4ncnc4cc3C)ncc2n(C)c1=O |r,wU:2.1,wD:5.8,(7.49,-4.89,;5.95,-4.89,;5.55,-3.4,;4.06,-3,;3.66,-1.51,;4.75,-.43,;6.24,-.82,;6.64,-2.31,;4.35,1.06,;2.89,1.54,;1.55,.77,;.22,1.54,;-1.11,.77,;-2.45,1.54,;-3.78,.77,;-5.12,1.54,;-6.58,1.06,;-7.49,2.31,;-6.58,3.55,;-5.12,3.08,;-3.78,3.85,;-2.45,3.08,;-1.11,3.85,;.22,3.08,;1.55,3.85,;2.89,3.08,;4.35,3.55,;5.12,4.89,;5.26,2.31,;6.8,2.31,)|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCCOC3)c2n1 |r|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CCCOC3)c2n1 |r|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@](C)(O)CC3)c2n1 |r,wU:20.21,23.25,wD:23.26,(3.5,1.28,;3.5,2.82,;4.83,3.59,;4.83,5.13,;5.97,6.16,;5.35,7.57,;3.82,7.41,;3.5,5.9,;2.16,5.13,;2.16,3.59,;.83,2.82,;-.51,3.59,;-1.84,2.82,;-3.17,3.59,;-3.17,5.13,;-4.32,6.16,;-5.8,5.76,;-3.69,7.57,;-4.46,8.9,;-2.16,7.41,;-1.07,8.5,;-1.47,9.99,;-.38,11.07,;1.11,10.68,;2.59,11.07,;1.11,12.22,;1.51,9.19,;.42,8.1,;-1.84,5.9,;-.51,5.13,)|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:20.21,23.26,wD:23.25,(3.5,1.28,;3.5,2.82,;4.83,3.59,;4.83,5.13,;5.97,6.16,;5.35,7.57,;3.82,7.41,;3.5,5.9,;2.16,5.13,;2.16,3.59,;.83,2.82,;-.51,3.59,;-1.84,2.82,;-3.17,3.59,;-3.17,5.13,;-4.32,6.16,;-5.8,5.76,;-3.69,7.57,;-4.46,8.9,;-2.16,7.41,;-1.07,8.5,;-1.47,9.99,;-.38,11.07,;1.11,10.68,;1.11,12.22,;2.59,11.07,;1.51,9.19,;.42,8.1,;-1.84,5.9,;-.51,5.13,)|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCOC3)c2n1 |r|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n(c2n1)[C@]1(C)CC[C@H](O)CC1 |r,wU:26.30,wD:22.26,(3.41,-5.24,;3.41,-3.7,;4.74,-2.93,;4.74,-1.39,;5.89,-.36,;5.26,1.05,;3.73,.89,;3.41,-.62,;2.08,-1.39,;2.08,-2.93,;.74,-3.7,;-.59,-2.93,;-1.92,-3.7,;-3.26,-2.93,;-3.26,-1.39,;-4.4,-.36,;-5.89,-.76,;-3.78,1.05,;-4.17,2.53,;-2.24,.89,;-1.92,-.62,;-.59,-1.39,;-1.15,1.97,;-2.64,2.37,;.33,1.58,;1.42,2.66,;1.02,4.15,;2.11,5.24,;-.46,4.55,;-1.55,3.46,)|
Cc1cc2ncnn2cc1Nc1ncc2n(C)c(=O)n(C3CCCCC3)c2n1
C(Nc1nc(nc2cccc(-c3ccccc3)c12)-c1cncnc1)c1ccccn1
Clc1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccn(C)n1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1cc(cc2nn(C)cc12)-c1ccn(CCC(F)(F)F)n1)[C@H]1CNC(=O)C1 |r|
C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cnn(c1)C(F)F)[C@H]1CNC(=O)C1 |r|
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)N3CCN(CC3)C(=O)C=C)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)N3CCC(CC3)NC(=O)C=C)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)Nc3ccc(NC(=O)C=C)cc3)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3ccc(cc3)S(=O)(=O)Nc3ccc(NC(=O)C=C)cc3)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)Nc3cccc(NC(=O)C=C)c3)nc12
CCC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(Nc2ncc3N(C)C(=O)c4cc(C)ccc4N(C)c3n2)c1
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)N3CCC(O)CC3)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(N)(=O)=O)nc12
CN1c2ccccc2C(=O)N(C)c2cnc(Nc3ccc(cc3C)S(N)(=O)=O)nc12
Cc1cc(Nc2ccc(F)c(CC3(CCN(Cc4cccc(Cl)c4F)CC3)C(O)=O)n2)n[nH]1
CCC1CC(Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2ccc(F)c(Nc3cc(C)n[nH]3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1c(F)ccc(Cl)c1F)C(O)=O
CC[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2C)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2Cl)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1c(F)cccc1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cccc(F)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cccc(C)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1c(Cl)cccc1Cl)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cccc(c1)C(F)(F)F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1cc(Cl)c(F)c(Cl)c1)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ncc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1Cc1ccc(F)c(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2cccc(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2cc(F)cc(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2cnc(C)c(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)n[nH]3)c(C)cc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1C(=O)Cc1cccc(Cl)c1F)C(O)=O |r|
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(CCN1C(=O)c1ccccc1C(F)(F)F)C(O)=O
C[C@H](N1CC[C@](Cc2nc(Nc3cc(C)[nH]n3)ccc2F)(C[C@H]1C)C(O)=O)c1cccc(Cl)c1F
C[C@@H]1C[C@@](Cc2cncc(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)cc(C)c2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)cc(C)c2F)(CCN1Cc1c(F)ccc(Cl)c1F)C(O)=O |r|
Cc1cc(Nc2cc(C)c(F)c(CC3(CCN(Cc4cccc(Cl)c4F)CC3)C(O)=O)n2)n[nH]1
Cc1cc(Nc2cc(C)c(F)c(CC3(CCN(Cc4cccc(F)c4F)CC3)C(O)=O)n2)n[nH]1
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)cc(C)c2F)(CCN1Cc1cccc(Cl)c1Cl)C(O)=O |r|
Cc1cc(Nc2cc(C)c(F)c(CC3(CCN(Cc4cccc(Cl)c4Cl)CC3)C(O)=O)n2)n[nH]1
Cc1cc(Nc2cc(C)c(F)c(CC3(CCN(Cc4c(F)ccc(Cl)c4F)CC3)C(O)=O)n2)n[nH]1
CCc1cc(Nc2cc(C)[nH]n2)nc(CC2(CCN(Cc3cccc(Cl)c3F)CC2)C(O)=O)c1F
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)n[nH]3)cc(C#N)c2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
CC(=O)c1cc(Nc2cc(C)[nH]n2)nc(CC2(CCN(Cc3cccc(Cl)c3F)CC2)C(O)=O)c1F
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)cc(Cl)c2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2cc(Cl)c(F)c(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O |r|
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)c(F)c(Cl)c2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O |r|
C[C@@H]1C[C@@](Cc2cc(C)c(F)c(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
Cc1cc(Nc2nc(CC3(CCN(Cc4cccc(Cl)c4F)CC3)C(O)=O)cc(C)c2F)n[nH]1
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)cc(c2F)S(C)(=O)=O)(CCN1Cc1cccc(Cl)c1F)C(O)=O |r|
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)c(Cl)c(Cl)c2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2cc(C#N)c(F)c(Nc3cc(C)[nH]n3)n2)(CCN1Cc1cccc(Cl)c1F)C(O)=O
C[C@@H]1C[C@@](Cc2nc(Nc3cc(C)[nH]n3)c(F)cc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
Cc1cc(Nc2nc(CC3(CCN(Cc4cccc(Cl)c4F)CC3)C(O)=O)c(F)cc2F)n[nH]1
CC1CC(Cc2nc(Nc3n[nH]c(C)c3C)ccc2F)(CCN1Cc1cccc(Cl)c1F)C(O)=O
Cc1cc(n[nH]1)Nc2ccc(c(n2)C[C@]3(CCN([C@@H](C3)C)Cc4cccc(c4F)Cl)C(=O)O)F
COc1ccc(cc1)Nc2c3cc[nH]c3ncn2
Brc1cccc(Nc2ncnc3[nH]ccc23)c1
O=C(Nc1ccc(Nc2ncnc3[nH]ccc23)cc1)c1ccccc1
O=S(=O)(Nc1ccc(Nc2ncnc3[nH]ccc23)cc1)c1ccccc1
O=C(Nc1ccccc1)c1ccc(Nc2ncnc3[nH]ccc23)cc1
C1NNC(Nc2ncnc3[nH]ccc23)=C1 |c:15|
C(Oc1ccc(Nc2ncnc3[nH]ccc23)cc1)c1ccccc1
CN[C@@H]1CC2OC([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncncc5C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncncc5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@]3(C[C@@H]3c3ccc4c(Nc5ncncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCOCC6)c5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(Cl)ncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nccnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(OC)ncn5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cccc6CCOc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncccc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCN(C)CC6)c5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(OC)ncc5Cl)n[nH]c4c3)c2c1
COc1nn(C)cc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cnn6CCOc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cccc6C(=O)COc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nccc6CCOc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nccc6[C@@H](CO)COc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nccc6[C@H](CO)COc56)n[nH]c4c3)c2c1
COC1CN(C1)c1cc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)ncn1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ncn5)N5CC(O)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6C7CCC6COC7)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(OCCO)ncn5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ncn5)N5CCS(=O)(=O)CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ncn5)N5CCCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CC(O)C6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ncn5)N5CCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CC(O)C6)c5Cl)n[nH]c4c3)c2c1
COC1CN(C1)c1ncnc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c1Cl
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(Cl)nc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(Cl)c(OC)c(n5)N5CCOCC5)n[nH]c4c3)c2c1
COc1nn(CCO)cc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCOCC6)c5OC)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6C[C@H](C)O[C@H](C)C6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCS(=O)(=O)CC6)c5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCS(=O)(=O)CC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(CCO)nc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(CCO)cnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6CCS(=O)(=O)CC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6CCS(=O)(=O)CC6)c5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nc(n5)C5CC5)N5CCS(=O)(=O)CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nc(C)n5)N5CCS(=O)(=O)CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCOCC6)c5OC)C#N)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCS(=O)(=O)CC6)c5OC)C#N)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cn(C)nc5C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cn(C)nc5C(F)(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cnn(C)c5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cn(C)nc5C#N)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6C[C@H](C)O[C@H](C)C6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(CCO)nc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCS(=O)(=O)CC6)c5OC)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCS(=O)(=O)CC6)c5Cl)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)cnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6CC(O)C6)c5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc(N6CC(O)C6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)nn5C)n[nH]c4c3)c2c1
COc1cnn(C)c1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CC(O)C6)c5Cl)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6C[C@H](C)O[C@H](C)C6)c5OC)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCS(=O)(=O)CC6)c5Cl)C(C)C)n[nH]c4c3)c2c1
COc1cn(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(cnc5OC)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CC(O)C6)c5OC)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)cnc5C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(cnc5OC)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc6N7CCS(=O)(=O)CC7COc56)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc(N6CCOCC6)c5OC)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)ncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ccc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)cnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nnccc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nn5C)C5CC5)n[nH]c4c3)c2c1
CCn1nc(cc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)C1CC1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(CC(C)(C)O)nc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(nc5OC)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccnc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)ncc5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(cnc5OC)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(cnc5OC)C5COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nnc5OC)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nc(n5)C(C)C)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5Cl)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CC(O)C6)c5Cl)n[nH]c4c3)c2c1
CCN1C(=O)[C@@]2(C[C@H]2c2ccc3c(Nc4ncnc(N5CC(O)C5)c4Cl)n[nH]c3c2)c2cc(OC)ccc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCOCC6)c5OC(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(cnc5OC)C5CNC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nc(n5)C(C)C)N5CC(O)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)nn5CC(F)F)n[nH]c4c3)c2c1
COc1ccc2N(C)C(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CCOCC6)c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CC(O)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cncc(n5)C5COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5Cl)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5Cl)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5Cl)C5COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)C5COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5Cl)N5CC(O)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OC(F)F)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)N(C)c2ccccc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OC)n[nH]c4c3F)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccccc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)C(C)C)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(C)cc12
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@]11C(=O)Nc2ccc(C)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC(F)F)C(C)C)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cccc(F)c12
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@]11C(=O)Nc2cccc(F)c12
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2cc(F)ccc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncnc(N6CC7(COC7)C6)c5Cl)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(F)cc12
CCOc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
Cc1ncc(OC(F)F)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(F)cc23)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OC(C)C)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(cc12)C(F)(F)F
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC(F)(F)F)cc12
COc1cnc(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@]11C(=O)Nc2ccc(OC(F)(F)F)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC(F)F)C5COC5)n[nH]c4c3)c2c1
COc1cnc(C)nc1Nc1n[nH]c2c(F)c(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(F)cc12
Cc1ncc(OC(F)F)c(Nc2n[nH]c3c(F)c(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(F)cc23)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3cc4[nH]nc(Nc5nc(C)ncc5OC)c4cc3F)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)nnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OCC5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OCC(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)ccc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5OCC(F)(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(C)nc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(nc(C)n5)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc6CCOc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)C5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(SC)ncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)C(F)(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc6CCCc56)n[nH]c4c3)c2c1
CCc1ncc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc6cccnc6cc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)ncc5SC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc6ccccc6cc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(OC)cnc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(Cl)nc6ccoc56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CC[C@@H](F)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCC(F)(F)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(Cl)nc6ccn(C)c56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)C#N)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CC(F)(F)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CC(F)C5)n[nH]c4c3)c2c1
CCS(=O)(=O)c1ccc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
CNC(=O)c1ccc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)S(=O)(=O)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)S(=O)(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)C(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5C)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5CC(F)(F)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5CCC(F)(F)CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3cc(F)c4c(Nc5nc(SC)ncc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(OC)ncc5C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5CC6(COC6)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCC(F)(F)CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CCS(=O)(=O)CC5)n[nH]c4c3)c2c1
CNC(=O)c1ccc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)N5CC6(COC6)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N(C)C(C)C)n[nH]c4c3)c2c1
CCOc1cnc(SC)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ccc5OC)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ncc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(cc5OC)C(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ncc5OC)C5CCOC5)n[nH]c4c3)c2c1
CCOc1nc(ccc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(C)(=O)=O
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)C(=O)N(C)C
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)P(C)(C)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(F)c(cc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(F)c(cc5OC)C(=O)N5CCOCC5)n[nH]c4c3)c2c1
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(C)(=O)=O
CCS(=O)(=O)c1ccc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)n1
CNS(=O)(=O)c1cc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)cc1C
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(C)nc6CSC(C)c56)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(OC)c(cc5OC)S(N)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(nc6CCCc56)N(C)C)n[nH]c4c3)c2c1
CCOc1nc(ccc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)C(=O)N(C)C
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)N5CCCC5=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)S(=O)(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc6cccnc6cc5OC)n[nH]c4c3)c2c1
CON(C)C(=O)c1ccc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)NNC(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)N5CCCC5=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)N5CCN(C)C5=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)S(=O)(=O)N(C)C)n[nH]c4c3)c2c1
CCOc1nc(ccc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(=O)(=O)N(C)C
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(ccc5OC)S(=O)(=O)C5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)P(C)(C)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)C(C)(C)O)n[nH]c4c3)c2c1
CCS(=O)(=O)c1cnc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(nc5OC)P(C)(C)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)NCC5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)NC(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5C6CCC5COC6)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nn(C)c(=O)cc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)-c5ncco5)n[nH]c4c3)c2c1
COC1CN(C1)C(=O)c1cnc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(nc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
CCOc1nc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)C(=O)N(C)C
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(C)c(nc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)S(C)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cnc(cc5OC)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(nc5OC)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N(C5CC5)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)NCC(F)F)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5[C@@H](C)CCC[C@H]5C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)N5CC6CCC(C5)O6)n[nH]c4c3)c2c1 |TLB:26:28:35:31.32|
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5Cl)S(C)(=O)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)C(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cnc(cc5OC)P(C)(C)=O)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C(=O)NC(CF)CF)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5Cl)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc6oc(C)nc6cc5Cl)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cnc(cc5OC)C(=O)N(C)C)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(nc5OC)C5CS(=O)(=O)C5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N5CC6CCC(C5)O6)n[nH]c4c3)c2c1
CCP(=O)(CC)c1ccc(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c(OC)n1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)C5CC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)C5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc(nc5OC)C#N)n[nH]c4c3)c2c1
CCP(=O)(CC)c1ccc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)c1
CCS(=O)(=O)c1cc(OC)c(Nc2n[nH]c3cc(ccc23)[C@@H]2C[C@@]22C(=O)Nc3ccc(OC)cc23)cn1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)C(=O)N5CCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)C(=O)N5CCOCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc6CN(C)C(=O)c6cc5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ccc6C(=O)N(C)Cc6c5OC)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N5CCCO5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N5CCC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)NC5(C)COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)N(C)C5(C)COC5)n[nH]c4c3)c2c1
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5cc(cnc5OC)C(C)O)n[nH]c4c3)c2c1
CCOc1cc(ccc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(C)(=O)=O
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(=O)(=O)N1CCN(C)CC1
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(=O)(=O)CC
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(=O)(=O)NC
CCOc1cc(cnc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(Cl)cc12)S(C)(=O)=O
CCOc1cc(=O)n(C)nc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5nc(ccc5OC)C(C)(C)O)n[nH]c4c3)c2c1
CCOc1cc(ncc1Nc1n[nH]c2cc(ccc12)[C@@H]1C[C@@]11C(=O)Nc2ccc(OC)cc12)S(C)(=O)=O
COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(Nc5ncc(cc5OC)S(=O)(=O)C(F)F)n[nH]c4c3)c2c1
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4ccnnc4cc3C)ncc2n(C)c1=O
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4nccnc4cc3C)ncc2n(C)c1=O
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4cncnc4cc3C)ncc2n(C)c1=O
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4ncc(C)nc4cc3C)ncc2n(C)c1=O
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4nc(C)cnc4cc3C)ncc2n(C)c1=O
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:24.26,wD:21.22,(3.34,-5.73,;3.34,-4.19,;4.68,-3.42,;4.68,-1.88,;6.01,-1.11,;6.01,.43,;4.68,1.2,;3.34,.43,;3.34,-1.11,;2.01,-1.88,;2.01,-3.42,;.68,-4.19,;-.66,-3.42,;-1.99,-4.19,;-3.33,-3.42,;-3.33,-1.88,;-4.47,-.85,;-6.01,-.85,;-3.84,.56,;-4.61,1.89,;-2.31,.4,;-1.54,1.73,;-0,1.73,;.77,3.06,;-0,4.4,;.77,5.73,;-1.54,4.4,;-2.31,3.06,;-1.99,-1.11,;-.66,-1.88,)|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:24.26,wD:21.22,(3.34,-5.73,;3.34,-4.19,;4.68,-3.42,;4.68,-1.88,;6.01,-1.11,;6.01,.43,;4.68,1.2,;3.34,.43,;3.34,-1.11,;2.01,-1.88,;2.01,-3.42,;.68,-4.19,;-.66,-3.42,;-1.99,-4.19,;-3.33,-3.42,;-3.33,-1.88,;-4.47,-.85,;-6.01,-.85,;-3.84,.56,;-4.61,1.89,;-2.31,.4,;-1.54,1.73,;-0,1.73,;.77,3.06,;-0,4.4,;.77,5.73,;-1.54,4.4,;-2.31,3.06,;-1.99,-1.11,;-.66,-1.88,)|
Cc1cc2nccc(C)c2cc1Nc1ncc2n(C)c(=O)n(C3CCC(O)CC3)c2n1 |(2.53,5.92,;3.86,6.69,;5.2,5.92,;6.53,6.69,;7.87,5.92,;9.2,6.69,;9.2,8.23,;7.87,9,;7.87,10.54,;6.53,8.23,;5.2,9,;3.86,8.23,;2.53,9,;1.2,8.23,;1.2,6.69,;-.14,5.92,;-1.47,6.69,;-2.94,6.22,;-3.41,4.75,;-3.84,7.46,;-5.38,7.46,;-2.94,8.71,;-3.41,10.17,;-4.92,10.49,;-5.39,11.96,;-4.36,13.1,;-4.84,14.57,;-2.86,12.78,;-2.38,11.32,;-1.47,8.23,;-.14,9,)|
COc1ccnc2cc(C)c(Nc3ncc4n(C)c(=O)n([C@H]5CC[C@H](O)CC5)c4n3)cc12 |r,wU:24.24,wD:21.20,(2.01,2.74,;2.01,1.2,;3.34,.43,;4.68,1.2,;6.01,.43,;6.01,-1.11,;4.68,-1.88,;4.68,-3.42,;3.34,-4.19,;3.34,-5.73,;2.01,-3.42,;.68,-4.19,;-.66,-3.42,;-1.99,-4.19,;-3.33,-3.42,;-3.33,-1.88,;-4.47,-.85,;-6.01,-.85,;-3.84,.56,;-4.61,1.89,;-2.31,.4,;-1.54,1.73,;-0,1.73,;.77,3.06,;-0,4.4,;.77,5.73,;-1.54,4.4,;-2.31,3.06,;-1.99,-1.11,;-.66,-1.88,;2.01,-1.88,;3.34,-1.11,)|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(C3CCC(O)CC3)c2n1 |(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-4.91,2.32,;-5.39,3.78,;-6.89,4.1,;-7.37,5.56,;-7.92,2.96,;-7.45,1.49,;-4,-.77,;-2.67,,)|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCC(O)CC3)c2n1 |(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-4.91,2.32,;-5.39,3.78,;-6.89,4.1,;-7.37,5.56,;-7.92,2.96,;-7.45,1.49,;-4,-.77,;-2.67,,)|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CC[C@H](O)CC3)c2n1 |r,wU:21.22,24.26,(3.34,-5.24,;3.34,-3.7,;4.68,-2.93,;4.68,-1.39,;6.01,-.62,;6.01,.92,;4.68,1.69,;3.34,.92,;3.34,-.62,;2.01,-1.39,;2.01,-2.93,;.68,-3.7,;-.66,-2.93,;-1.99,-3.7,;-3.33,-2.93,;-3.33,-1.39,;-4.47,-.36,;-6.01,-.36,;-3.84,1.05,;-4.61,2.38,;-2.31,.89,;-1.22,1.97,;.26,1.58,;1.35,2.66,;.95,4.15,;2.04,5.24,;-.53,4.55,;-1.62,3.46,;-1.99,-.62,;-.66,-1.39,)|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:24.26,wD:21.22,24.27,(3.32,3.93,;3.32,5.47,;4.65,6.24,;4.65,7.78,;5.98,8.55,;5.98,10.09,;4.65,10.86,;3.32,10.09,;3.32,8.55,;1.98,7.78,;1.98,6.24,;.65,5.47,;-.68,6.24,;-2.02,5.47,;-3.35,6.24,;-3.35,7.78,;-4.5,8.81,;-5.98,8.41,;-3.87,10.22,;-4.64,11.55,;-2.34,10.06,;-1.25,11.14,;.24,10.75,;1.33,11.83,;.93,13.32,;.93,14.86,;2.47,13.32,;-.56,13.72,;-1.65,12.63,;-2.02,8.55,;-.68,7.78,)|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@](C)(O)CC3)c2n1 |r,wU:24.27,wD:21.22,24.26,(3.32,3.93,;3.32,5.47,;4.65,6.24,;4.65,7.78,;5.98,8.55,;5.98,10.09,;4.65,10.86,;3.32,10.09,;3.32,8.55,;1.98,7.78,;1.98,6.24,;.65,5.47,;-.68,6.24,;-2.02,5.47,;-3.35,6.24,;-3.35,7.78,;-4.5,8.81,;-5.98,8.41,;-3.87,10.22,;-4.64,11.55,;-2.34,10.06,;-1.25,11.14,;.24,10.75,;1.33,11.83,;.93,13.32,;.93,14.86,;2.47,13.32,;-.56,13.72,;-1.65,12.63,;-2.02,8.55,;-.68,7.78,)|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:24.26,wD:21.22,24.27,(3.32,3.93,;3.32,5.47,;4.65,6.24,;4.65,7.78,;5.98,8.55,;5.98,10.09,;4.65,10.86,;3.32,10.09,;3.32,8.55,;1.98,7.78,;1.98,6.24,;.65,5.47,;-.68,6.24,;-2.02,5.47,;-3.35,6.24,;-3.35,7.78,;-4.5,8.81,;-5.98,8.41,;-3.87,10.22,;-4.64,11.55,;-2.34,10.06,;-1.25,11.14,;.24,10.75,;1.33,11.83,;.93,13.32,;.93,14.86,;2.47,13.32,;-.56,13.72,;-1.65,12.63,;-2.02,8.55,;-.68,7.78,)|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CC[C@](C)(O)CC3)c2n1 |r,wU:24.27,wD:21.22,24.26,(3.32,3.93,;3.32,5.47,;4.65,6.24,;4.65,7.78,;5.98,8.55,;5.98,10.09,;4.65,10.86,;3.32,10.09,;3.32,8.55,;1.98,7.78,;1.98,6.24,;.65,5.47,;-.68,6.24,;-2.02,5.47,;-3.35,6.24,;-3.35,7.78,;-4.5,8.81,;-5.98,8.41,;-3.87,10.22,;-4.64,11.55,;-2.34,10.06,;-1.25,11.14,;.24,10.75,;1.33,11.83,;.93,13.32,;.93,14.86,;2.47,13.32,;-.56,13.72,;-1.65,12.63,;-2.02,8.55,;-.68,7.78,)|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(C3CC[C@@](C)(O)CC3)c2n1 |r,wU:24.26,wD:24.27,(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-4.91,2.32,;-5.39,3.78,;-6.89,4.1,;-6.32,5.53,;-8.2,4.92,;-7.92,2.96,;-7.45,1.49,;-4,-.77,;-2.67,,)|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(C3CC[C@@](C)(O)CC3)c2n1 |r,wU:24.27,wD:24.26,(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-7.45,1.49,;-7.92,2.96,;-6.89,4.1,;-6.32,5.53,;-8.2,4.92,;-5.39,3.78,;-4.91,2.32,;-4,-.77,;-2.67,,)|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(c2n1)[C@]1(C)CC[C@H](O)CC1 |r,wU:27.31,wD:23.27,(3.32,-5.24,;3.32,-3.7,;4.65,-2.93,;4.65,-1.39,;5.98,-.62,;5.98,.92,;4.65,1.69,;3.32,.92,;3.32,-.62,;1.98,-1.39,;1.98,-2.93,;.65,-3.7,;-.68,-2.93,;-2.02,-3.7,;-3.35,-2.93,;-3.35,-1.39,;-4.5,-.36,;-5.98,-.76,;-3.87,1.05,;-4.64,2.38,;-2.34,.89,;-2.02,-.62,;-.68,-1.39,;-1.25,1.97,;-2.74,2.37,;.24,1.58,;1.33,2.66,;.93,4.15,;2.02,5.24,;-.56,4.55,;-1.65,3.46,)|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCOC3)c2n1 |r|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCOC3)c2n1 |r|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CCOC3)c2n1 |r|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CCOC3)c2n1 |r|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n(C3CCCOC3)c2n1
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(C3CCCOC3)c2n1
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCCOC3)c2n1 |r|
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n([C@H]3CCCOC3)c2n1 |r|
Cc1cc2nnccc2cc1Nc1ncc2n(C)c(=O)n(C3CCOCC3)c2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCOCC3)c2n1
Cc1cc2nccnc2cc1Nc1ncc2n(C)c(=O)n(C3CCOCC3)c2n1
Cc1cc2ncncc2cc1Nc1ncc2n(C)c(=O)n(C3CCOCC3)c2n1
Cc1cnc2cc(C)c(Nc3ncc4n(C)c(=O)n(C5CCOCC5)c4n3)cc2n1
Cc1cnc2cc(Nc3ncc4n(C)c(=O)n(C5CCOCC5)c4n3)c(C)cc2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCS(=O)(=O)CC3)c2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3COC3)c2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCNCC3)c2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n([C@@H]3CCNC[C@@H]3F)c2n1 |r|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CC[C@@](C)(N)CC3)c2n1 |r,wU:24.27,wD:24.26,(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-7.45,1.49,;-7.92,2.96,;-6.89,4.1,;-6.32,5.53,;-8.2,4.92,;-5.39,3.78,;-4.91,2.32,;-4,-.77,;-2.67,,)|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CC[C@@](C)(N)CC3)c2n1 |r,wU:24.26,wD:24.27,(,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-4,-2.31,;-5.47,-2.79,;-5.94,-4.25,;-6.37,-1.54,;-7.91,-1.54,;-5.47,-.29,;-5.94,1.17,;-4.91,2.32,;-5.39,3.78,;-6.89,4.1,;-6.32,5.53,;-8.2,4.92,;-7.92,2.96,;-7.45,1.49,;-4,-.77,;-2.67,,)|
CN1CC[C@H](C1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O |r|
CN1CC[C@@H](C1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O |r|
CN1CCC(CC1)n1c2nc(Nc3cc4ccnnc4cc3C)ncc2n(C)c1=O
CN1CCC(CC1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O
CN1CCC(CC1)n1c2nc(Nc3cc4nccnc4cc3C)ncc2n(C)c1=O
CN1CC[C@H]([C@@H](F)C1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O |r|
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCN(CC3)C3COC3)c2n1
Cc1cc2ncccc2cc1Nc1ncc2n(C)c(=O)n(C3CCN(CCO)CC3)c2n1
COCCN1CCC(CC1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O
CCN1CCC(CC1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O
CC(=O)N1CCC(CC1)n1c2nc(Nc3cc4cccnc4cc3C)ncc2n(C)c1=O
Cc1cc2c(cccn2)cc1Nc3ncc4c(n3)N(C(=O)N4C)[C@@H]5CNC[C@H]5F
O=C(O)c1ccc(Nc2ncnc3[nH]ccc23)cc1
c1cc(Nc2ncnc3[nH]ccc23)[nH]n1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
Fc1ccc(cc1)C(=O)Nc1cccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)c1
Clc1cccc(c1)C(=O)Nc1ccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)cc1
Clc1ccc(cc1)C(=O)Nc1ccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)cc1
O=C(Nc1ccccc1)Nc1cccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)c1
Clc1cccc(NC(=O)Nc2cccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)c2)c1
Clc1ccc(NC(=O)Nc2cccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)c2)cc1
Fc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
Clc1cccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)c1
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCC5CCCCN5)cc4s3)cc2)cc1
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1Cl
COc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
Clc1ccc(NC(=S)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
COc1ccc(NC(=S)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
Clc1ccc(cc1)C(=O)Nc1cccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)c1
COc1ccc(cc1)C(=O)Nc1ccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)cc1
O=C(Nc1ccccc1)Nc1ccc(CNc2nc3ccc(OCCN4CCOCC4)cc3s2)cc1
CN(C)CCOc1ccc2nc(NCc3ccc(NC(=O)Nc4ccc(Cl)cc4)cc3)sc2c1
Brc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4s3)cc2)cc1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1
Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1
CN1C(=O)NC(Cc2c[nH]c3c(Cl)cccc23)C1=O
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1
CN1CCN(CC1)c1nc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CCCCC3)cc2)n1
COc1n[nH]c2ncc(cc12)C#Cc1c(F)ccc(NS(=O)(=O)c2cccc(c2)C#N)c1F
NC(=O)c1c(O)cc(O)c2c1oc1c2[nH]c(=O)[nH]c1=O
NC(=O)c1c(O)cc(O)c2c3nc[nH]c(=O)c3oc12
NC(=O)c1c(O)cc(O)c2c1oc1c(N)ncnc21
CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6|
COC(=O)c1ccc(Nc2nc(Nc3cc(C)[nH]n3)cc(n2)N2CCN(C)CC2)cc1F
Cc1cc(Nc2cc(nc(Nc3ccc(F)c(Cl)c3)n2)N2CCOCC2)n[nH]1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(F)c(Cl)c2)n1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(Cl)c(F)c2)n1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(F)c(F)c2)n1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(F)cc2)n1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2cccc(F)c2)n1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(Cl)c(Cl)c2)n1
COc1ccc(Nc2nc(Nc3cc(C)[nH]n3)cc(n2)N2CCN(C)CC2)c(OC)c1OC
COC(=O)c1ccc(Nc2nc(Nc3cc(C)[nH]n3)cc(n2)N2CCN(C)CC2)cc1OC
COc1ccc(Nc2nc(Nc3cc(C)[nH]n3)cc(n2)N2CCN(C)CC2)cc1OC
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc3OCOc3c2)n1
CN(C)Cc1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
CN(C)Cc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
CN(C)Cc1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
CCc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
Cc1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
OC1CCN(Cc2ccccc2NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)CC1
OC1CCN(Cc2cccc(NC(=O)Nc3ccc(CCNc4ncnc5oc(c(Cl)c45)-c4ccccc4)cc3)c2)CC1
OC1CCN(Cc2ccc(NC(=O)Nc3ccc(CCNc4ncnc5oc(c(Cl)c45)-c4ccccc4)cc3)cc2)CC1
CCN(C)Cc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
Cc1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
CCN(CC)Cc1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
CC(C)Cc1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
Clc1c(oc2ncnc(NCCc3ccc(NC(=O)Nc4ccccc4)cc3)c12)-c1ccccc1
CCc1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
CC(C)Cc1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
Clc1c(oc2ncnc(NCCc3ccc(NC(=O)Nc4ccccc4CN4CCCCC4)cc3)c12)-c1ccccc1
Cc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
CC(C)Cc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
CCN(CC)Cc1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
Clc1c(oc2ncnc(NCCc3ccc(NC(=O)Nc4cccc(CN5CCCCC5)c4)cc3)c12)-c1ccccc1
CC(C)c1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
CCN(CC)Cc1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
Clc1c(oc2ncnc(NCCc3ccc(NC(=O)Nc4ccc(CN5CCCCC5)cc4)cc3)c12)-c1ccccc1
CC(C)c1ccccc1NC(=O)Nc1ccc(CCNc2ncnc3oc(c(Cl)c23)-c2ccccc2)cc1
CCc1ccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)cc1
CC(C)c1cccc(NC(=O)Nc2ccc(CCNc3ncnc4oc(c(Cl)c34)-c3ccccc3)cc2)c1
CCC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(cc2)Nc3ncc4c(n3)N(c5ccc(cc5C(=O)N4C)C)C
CCOC(=O)c1c2c(c[nH]1)[C@@H](C3=C(N2)CCCC3=O)c4cccc(c4)Oc5[nH]c6ccccc6n5
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3ccc(NC(=O)c4ccc(NC(=O)C=C)cc4)cc3)nc12
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(cc1)N1CCN(C)CC1
Nc1nc(Nc2ccc3CC[C@@H](CCc3c2)N2CCCC2)nn1-c1cc2CCCc3ccccc3-c2nn1 |r|
CCCCCCCCCCCCCCCCOP([O-])(=O)OCC[N+](C)(C)C
c1cc(ccc1C(=N)N)OCCCCCOc2ccc(cc2)C(=N)N
[H][C@]12C[C@@H](O[C@]3([H])O[C@H](C)[C@@H](O)[C@H](N)[C@@H]3O)\C=C\C=C\C=C\C=C\C=C\C=C\C=C\[C@H](C)[C@@H](O)[C@@H](C)[C@H](C)OC(=O)C[C@H](O)C[C@H](O)CC[C@@H](O)[C@H](O)C[C@H](O)C[C@](O)(C[C@H](O)[C@H]1C(O)=O)O2 |r,wU:62.64,57.58,10.10,32.33,1.0,5.5,wD:3.3,12.12,14.15,60.61,51.52,54.55,49.50,42.43,34.35,45.46,8.8,36.37,30.31,t:17,19,21,23,27,29,(-9.21,4.62,;-9.51,3.64,;-8.06,4.03,;-7.11,2.79,;-6.63,1.32,;-5.12,1,;-4.49,.19,;-6.09,2.18,;-5.52,3.61,;-6.28,4.58,;-3.99,3.82,;-3.61,4.78,;-3.04,2.61,;-1.82,2.79,;-3.61,1.18,;-2.86,.2,;-5.59,3.01,;-4.6,1.87,;-3.07,2.09,;-2.12,1,;-.68,1.25,;.41,.08,;1.8,.35,;2.79,-.78,;4.26,-.58,;7.2,-.01,;6.73,-1.44,;7.74,-2.62,;7.26,-4.01,;9.36,-5.18,;8.86,-7.52,;9.7,-8.43,;7.25,-7.74,;6.8,-8.88,;6.25,-6.52,;6.71,-5.37,;4.67,-6.71,;4.24,-7.86,;3.59,-5.49,;2.05,-5.69,;1.63,-6.85,;.98,-4.53,;-.55,-4.69,;-1.01,-5.83,;-1.54,-3.51,;-3.06,-3.7,;-3.5,-4.85,;-4.14,-2.5,;-5.71,-2.68,;-6.76,-1.49,;-6.32,-.34,;-8.34,-1.66,;-8.79,-2.8,;-9.38,-.46,;-10.97,-.66,;-11.4,-1.81,;-12.06,.58,;-11.58,1.99,;-12.79,1.76,;-12.54,3.11,;-12.01,4.55,;-12.8,5.49,;-10.52,4.8,;-9.54,6,;-9.98,7.15,;-8.33,5.8,;-10.07,2.21,)|
[O-][N+](=O)c1nccn1CC(=O)NCc1ccccc1
CCN(CCO)Cc1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1
Cc1cn2c(cnc2c(Nc2cc(Cc3ccc(F)cn3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cn3cccc3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(n3)C(=O)N3CCCCC3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC(C)(C)C)c2ccccn2)n1)-c1cn[nH]c1
Cc1ccnc(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cn[nH]c3)sn2)c1
Cc1cn2c(cnc2c(Nc2cc(Cc3nccs3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(F)n3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(N2CCC(F)CC2)c2ccccn2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3ccncc3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cccnc3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cnccn3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3ncccn3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cn3ccnc3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC2CCCC2)c2ccccn2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(N2CCCC2)c2ccccn2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(CN4CCCCC4)n3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(CO)n3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3ncccc3F)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3ncccc3C)ns2)n1)-c1cn[nH]c1
Cc1ccc(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cn[nH]c3)sn2)nc1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(N2CCCCC2)c2ccccn2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cc3ccccn3)ns2)n1)-c1cn[nH]c1
COc1cccc(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cn[nH]c3)sn2)n1
Cc1cn2c(cnc2c(Nc2cc(Cn3cccc(C)c3=O)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(Cn3cccn3)ns2)n1)-c1cn[nH]c1
Cc1cccc(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cn[nH]c3)sn2)n1
Cn1cc(cn1)-c1nn(Cc2ccc(cc2)C(=O)NC2CCCCC2)c(=O)c2ccccc12
Cn1cc(cn1)-c1nn(Cc2ccc(cc2)C(=O)NC2CC(C)(C)N(O)C(C)(C)C2)c(=O)c2ccccc12
Cn1cc(Nc2nn(Cc3ccc(cc3)C(=O)NC3CCCCC3)c(=O)c3ccccc23)cn1
Cn1cc(cn1)-c1nn(Cc2ccc(cc2)C(=O)NC2CCCC2)c(=O)c2ccccc12
CN1CCC(CC1)NC(=O)c1ccc(Cn2nc(-c3cnn(C)c3)c3ccccc3c2=O)cc1
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(C)=O)cc2)n1
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
ON1C(=O)C(=C(C1=O)c1c[nH]c2ncccc12)c1c[nH]c2ccccc12 |c:4|
ON1C(=O)C(=C(C1=O)c1cn(CCCCCC(O)=O)c2ccccc12)c1c[nH]c2ccccc12 |c:4|
O=C1NC(=O)C(=C1c1cn(CCCCCC#N)c2ccccc12)c1cn(CCCCCC#N)c2ccccc12 |c:5|
CC(C)n1cc(C2=C(C(=O)N(O)C2=O)c2c[nH]c3ccccc23)c2ccccc12 |t:6|
Cn1cc(C2=C(C(=O)N(O)C2=O)c2c[nH]c3ccccc23)c2ccccc12 |t:4|
Cn1cc(C2=C(C(=O)N(O)C2=O)c2cn(CCCCCC#N)c3ccccc23)c2ccccc12 |t:4|
ON1C(=O)C(=C(C1=O)c1cn(CCCCCC#N)c2ccccc12)c1cn(CCCCCC#N)c2ccccc12 |c:4|
ON1C(=O)C2=C(C1=O)c1cn(CCCCCCn3cc2c2ccccc32)c2ccccc12 |c:4|
CCn1cc(C2=C(C(=O)N(O)C2=O)c2cn(C(C)C)c3ccccc23)c2ccccc12 |t:5|
CC(C)n1cc(C2=C(C(=O)N(O)C2=O)c2cn(C)c3ccccc23)c2ccccc12 |t:6|
Cn1cc(C2=C(C(=O)N(O)C2=O)c2cn(CCCCCC(O)=O)c3ccccc23)c2ccccc12 |t:4|
CCn1cc(C2=C(C(=O)N(O)C2=O)c2cn(C)c3ccccc23)c2ccccc12 |t:5|
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C)c3ncccc23)c2ccccc12 |t:4|
Cn1cc(C2=C(C(=O)N(O)C2=O)c2cn(C)c3ccccc23)c2ccccc12 |t:4|
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1
COc1cc(OC)cc(c1)C(=O)N[C@H]1CC[C@@H](CC1)Nc1nc(C)cc(n1)N(C)C |r,wU:13.13,wD:16.20,(83.25,-23.35,;83.25,-21.81,;81.92,-21.03,;81.92,-19.49,;80.58,-18.72,;80.58,-17.18,;81.91,-16.41,;79.25,-19.49,;79.25,-21.02,;80.58,-21.8,;77.91,-21.79,;77.91,-23.33,;76.58,-21.01,;75.25,-21.78,;75.24,-23.32,;73.92,-24.09,;72.59,-23.32,;72.58,-21.78,;73.92,-21.01,;71.26,-24.08,;69.92,-23.32,;68.58,-24.09,;67.25,-23.32,;65.91,-24.09,;67.25,-21.78,;68.58,-21,;69.92,-21.77,;68.58,-19.46,;67.24,-18.7,;69.91,-18.69,)|
CCn1cc(-c2ccc3N(CCc3c2)C(=O)Cc2cccc(OC(F)(F)F)c2)c2c(N)ncnc12
Clc1cccc(NC(=O)NC2NC=C(CCNc3ncnc4sccc34)S2)c1 |t:12|
Cc1csc(c1)-c1nnc(Nc2ccc(Oc3ncccc3-c3ccnc(N)n3)cc2)c2ccccc12
c1cc2c(cc1CN3CCOCC3)nc([nH]2)c4c(c[nH]n4)NC(=O)NC5CC5
CC(=O)NCC(=O)N1[C@H]2CC[C@@H]1c3c2ccc(c3)Nc4ncc(c(n4)NC5CCC5)C(F)(F)F
COc1cc2c(Nc3ccc(cc3)C(=O)Nc3ccccc3)ncnc2cc1O
CCc1cccc(CC)c1NC(=O)N1Cc2[nH]nc(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1
CCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN(C)C)c1
COc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(cc4)NC(=O)c5ccccc5
Cc1c(c([nH]c1/C=C\2/c3ccccc3NC2=O)C)CCC(=O)O
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)c3cccc(C)c3)cc2c1C(N)=O)C(C)C
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)c3ccn(C)n3)cc2c1C(N)=O)C(C)C
CCS(=O)(=O)Nc1cc(C(C)C)c2sc(NC(=O)NC)c(C(N)=O)c2c1
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)c3cc(C)cs3)cc2c1C(N)=O)C(C)C
CC(C)c1cc(NS(=O)(=O)c2ccccc2)cc2c(C(N)=O)c(NC(=O)C3CC3)sc12
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)c3ccccc3)cc2c1C(N)=O)C(C)C
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)N(C)C)cc2c1C(N)=O)C(C)C
CCCNS(=O)(=O)Nc1cc(C(C)C)c2sc(NC(=O)NC)c(C(N)=O)c2c1
CNC(=O)Nc1sc2c(cc(NS(=O)(=O)c3cccs3)cc2c1C(N)=O)C(C)C
CNc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(C)cc2)n1 |c:15|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(C)cc2)n1 |c:15|
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(C=Cc2ccccc2)n1 |w:19.20|
CCN(CC)c1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(C)cc2)n1 |c:18|
Cc1[nH]nc2Nc3nc(ncc3C(=Nc12)c1ccc(C)cc1)N1CCOCC1 |c:13|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccccc2C)n1 |c:15|
COc1ccc(cc1)C1=Nc2c(Nc3nc(SC)ncc13)n[nH]c2C |t:9|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccccc2Cl)n1 |c:15|
CN1CCN(CC1)c1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(C)cc2)n1 |c:21|
Cc1[nH]nc2Nc3nc(NC(C)(C)C)ncc3C(=Nc12)c1ccc(C)cc1 |c:18|
CC(C)Nc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(C)cc2)n1 |c:17|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccccc2C(F)(F)F)n1 |c:15|
COc1ccccc1C1=Nc2c(Nc3nc(SC)ncc13)n[nH]c2C |t:9|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(Cl)cc2)n1 |c:15|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2cccc(Cl)c2)n1 |c:15|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccccc2)n1 |c:15|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2cccc(F)c2)n1 |c:15|
Cc1[nH]nc2Nc3nc(ncc3C(=Nc12)c1ccc(C)cc1)N1CCCCC1 |c:13|
CSc1ncc2c(Nc3n[nH]c(C)c3N=C2c2ccc(cc2)C(F)(F)F)n1 |c:15|
CN1CCN(CC1)c1ccc2c(Nc3cc[nH]n3)nc(nc2c1)-c1ccccc1
CC(C)c1nc(Nc2cc(C)[nH]n2)c2ccccc2n1
COc1cccc(OC)c1C(=O)c1nc(Nc2cc(C)[nH]n2)c2ccc(cc2n1)N1CCC(CC1)C(=O)OC(C)(C)C
COc1cccc2c(Nc3cc(C)[nH]n3)nc(Cc3ccccc3)nc12
Cc1cc(Nc2nc(nc3cc(ccc23)N2CCC(CC2)C(O)=O)-c2ccccc2)n[nH]1
CN1CCN(CC1)c1ccc2c(Nc3cc(C)[nH]n3)nc(nc2c1)-c1ccccc1
Cc1cc(Nc2nc(nc3cc(ccc23)[N+]([O-])=O)-c2ccccc2)n[nH]1
Cc1cc(Nc2nc(nc3cc(F)ccc23)-c2ccccc2)n[nH]1
COc1ccc(cc1)C(=O)c1nc(Nc2cc(C)[nH]n2)c2ccc(Cl)cc2n1
Cc1cc(Nc2nc(nc3c(cccc23)[N+]([O-])=O)-c2ccccc2)n[nH]1
COc1cccc2c(Nc3cc(C)[nH]n3)nc(nc12)-c1ccccc1
Cc1cc(Nc2nc(nc3ccccc23)-c2ccc3ccccc3c2)n[nH]1
Cc1cc(Nc2nc(nc3ccccc23)-c2ccccc2)[nH]n1
CCOC(=O)C1CCN(CC1)c1ccc2c(Nc3cc(C)[nH]n3)nc(nc2c1)-c1ccccc1
Cc1cc(Nc2nc(nc3cc(Cl)ccc23)-c2ccccc2)n[nH]1
Cc1cc(Nc2nc(Cc3ccccc3)nc3ccccc23)n[nH]1
COc1ccc2c(Nc3cc(C)[nH]n3)nc(nc2c1)-c1ccccc1
Cc1cc(Nc2nc(nc3cc(Cl)ccc23)C(=O)c2ccc(C)cc2)n[nH]1
Cc1cc(Nc2nc(nc3ccccc23)C(=O)c2ccccc2)n[nH]1
Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12
COc1cc(O)c(C(O)=O)c(c1)-c1cc(O)c(O)cc1C
COc1cc(O)c2c(c1)c1c(C)cc(O)c(O)c1oc2=O
COc1cc(O)c(C(O)=O)c(c1)C1=C(C)C[C@@H](O)C1=O |r,wD:16.17,c:13,(10.48,-22.79,;11.26,-21.46,;10.49,-20.12,;11.26,-18.8,;10.49,-17.47,;11.26,-16.14,;8.97,-17.47,;8.2,-16.14,;8.96,-14.8,;6.65,-16.13,;8.21,-18.79,;8.97,-20.12,;6.66,-18.79,;5.76,-17.54,;4.98,-16.2,;4.29,-18.01,;4.29,-19.55,;3.04,-20.45,;5.75,-20.03,;6.22,-21.5,)|
Cc1cc(O)c(O)cc1-c1cc(O)cc(O)c1C(O)=O
[H][C@]12[C@@H](O)CC(=O)c3c(O)ccc(-c4ccc(O)c5C(=O)CC[C@]1(O)c45)c23 |r|
COc1cc2c(C(=O)OC22C(C)CC(=O)C2=O)c(O)c1
COc1cc(O)c2c(c1)-c1cc(O)c(O)cc1COC2=O
Cc1cc(O)cc2oc(=O)c3c(O)cc(OS(O)(=O)=O)cc3c12
COc1cc(O)c2c(c1)c1c(C)cc(O)cc1oc2=O
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1-c1c(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2cc1OC |r,wU:18.19,11.11,13.13,wD:16.16,t:9,(-6.62,-6.52,;-5.29,-5.75,;-3.96,-6.52,;-3.96,-8.06,;-2.63,-8.83,;-2.63,-10.37,;-1.3,-8.07,;.04,-8.83,;.05,-10.37,;1.38,-8.06,;1.38,-6.5,;2.72,-5.72,;2.71,-4.19,;4.06,-6.5,;4.82,-5.16,;5.38,-7.27,;4.07,-8.06,;5.4,-8.82,;2.72,-8.83,;2.72,-10.37,;.03,-5.73,;.02,-4.19,;-1.3,-6.52,;-2.63,-5.75,;-2.6,-3.5,;-1.27,-2.73,;.06,-3.5,;-1.26,-1.19,;.06,-.41,;1.4,-1.16,;.05,1.13,;1.37,1.91,;1.36,3.45,;2.68,4.23,;.01,4.21,;-.01,5.74,;-1.31,3.42,;-1.29,1.89,;-2.62,1.11,;-3.96,1.87,;-2.6,-.43,;-3.93,-1.19,;-3.93,-2.74,;-5.26,-3.5,;-6.59,-2.73,)|
COc1cc(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1 |r,t:9|
COc1cc(O)c2C(=O)c3c(O)c(O)c(C)cc3C(=O)c2c1
CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F
OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
c1cc2cc(ccc2nc1)/C=C/3C(=O)N=C(S3)NCc4cccs4
Clc1[nH]c2ccccc2c1\C=C1\C(=O)Nc2ccccc12
CCN(CC)C(=O)c1ccc(cc1)Nc2nc3c(c(n2)OCC4CCCCC4)[nH]cn3
NS(=O)(=O)c1ccc(Nc2ncn(n2)C(=O)c2c(F)cccc2F)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3cccc(Cl)c3)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(Br)c(Nc3ccccc3Cl)n2)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccccc3Cl)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccc(Cl)cc3)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3cccc(O)c3)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccc(cc3)C(=O)Nc3ccccc3Cl)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccc(cc3)C(=O)Nc3cccc(Cl)c3)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(F)c(Nc3ccc(cc3)C(=O)Nc3ccccc3Cl)n2)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(Cl)c(Nc3ccccc3Cl)n2)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccccc3O)n2)[N+]([O-])=O)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccc(O)cc3)n2)[N+]([O-])=O)cc1
CN1CCC(CC1)NC(=O)c1ccc(Nc2ncc(F)c(Nc3ccc(cc3)C(=O)Nc3ccccc3Cl)n2)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3Cl)n2)cc1
CC1(C)CC(CC(C)(C)N1O)NC(=O)c1ccc(Nc2ncc(c(Nc3ccc(cc3)C(=O)Nc3ccc(Cl)cc3)n2)[N+]([O-])=O)cc1
O=C(Cc1ccc(cc1)-c1ccccc1)Nc1cc([nH]n1)C1CCC1
COc1cc(Br)cc2[nH]c(I)c(-c3cnc(o3)-c3ccc[nH]3)c12
COc1cc(Br)cc2[nH]cc(-c3oc(nc3I)-c3ccc[nH]3)c12
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3ccc(Br)[nH]3)c12
COc1cc2c(c[nH]c2cc1Br)-c1cnc(o1)-c1ccc[nH]1
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3cc(Br)c[nH]3)c12
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3ccc[nH]3)c12
Cc1ccc2n(c(CCN3C(=O)c4cccc5cccc(C3=O)c45)nc2c1)-c1ccncc1
Cc1cc(Nc2nc(Nc3ccc(cc3)C(=O)NC3CC(C)(C)N(O)C(C)(C)C3)ncc2F)no1
CCCCOC(=O)Cc1cc(Nc2nc(Nc3ccc(cc3)C(=O)NC3CC(C)(C)N([O])C(C)(C)C3)ncc2F)n[nH]1 |^1:31|
Clc1ccc(cc1Cl)C(=O)Nc1ccc2cc(ccc2c1)C(=O)Nc1nccs1
CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccncc1
CCc1ccc2n(C)c(C)c(C(=O)Nc3ccc(Oc4ncnc5cc(OC)c(OC)cc45)c(F)c3)c(=O)c2c1
COc1ccc(cc1)C1CC(=NN1C(=S)Nc1cccc(OC)c1)c1ccc2ccccc2c1O |c:11|
COc1ccc2NC(=O)C(=Cc3ccc4c(n[nH]c4c3)-c3ccc(nc3)N3CCN(C)CC3)c2c1
Cn1cc(cn1)-c1cc2nccnc2c(NC[C@@H]2CNCCO2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@@H]2CNCCC2(F)F)n1 |r|
Cc1ccc(s1)-c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NCCC(N)=O)n1
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@H]2CNCCN2C)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(CCC2CCCNC2)n1
C(Nc1nc(cc2nccnc12)-c1cc[nH]n1)[C@H]1CCCNC1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NCC(F)(F)F)n1
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@H]2CNCCO2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@H]2CNCCC2(F)F)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@@H]2CNCCN2C)n1 |r|
Cc1ccc(cc1)-c1cc2ncccc2c(NC[C@H]2CCCNC2)n1 |r|
Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1 |r|
Cc1ccc(cc1)-c1cc2ncn(C)c(=O)c2c(NC[C@H]2CCCNC2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(OC[C@H]2CCCNC2)n1
CN(C)c1ccc(cn1)-c1cc2nccnc2c(OC[C@@H]2CCCNC2)n1 |r|
Cc1ccc(o1)-c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
Cn1cc(cn1)-c1cc2nccnc2c(OC[C@H]2CCCNC2)n1 |r|
Cn1cc(cn1)-c1cc2nccnc2c(NC[C@@H]2CNCCC2(F)F)n1 |r|
CN1CCNC[C@H]1CNc1nc(cc2nccnc12)-c1cnn(C)c1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NCCCCO)n1
Cc1ccc(cc1)-c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2ncccc2c(NC[C@H]2CCCNC2)n1 |r|
C(Nc1nc(cc2nccnc12)-c1cn[nH]c1)[C@H]1CCCNC1 |r|
Cn1cc(cn1)-c1cc2nccnc2c(NCC2CNCC(F)(F)C2)n1
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NCCCCN)n1
O=C1CN(CCN1)c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
C(Nc1nc(cc2nccnc12)N1CCNCC1)[C@H]1CCCNC1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NC[C@@H]2CNCCO2)n1 |r|
CN(C)c1ccc(cn1)-c1cc2nccnc2c(NCC2CNCC(F)(F)C2)n1
Cc1ccc(cc1)-c1cc2ncncc2c(NC[C@H]2CCCNC2)n1 |r|
CN(C)c1ccc(cn1)-c1cc(NC[C@H]2CCCNC2)c2cccnc2c1 |r|
Cn1cc(cn1)-c1cc2nccnc2c(NC[C@H]2CCCNC2)n1 |r|
Cn1cc(cn1)-c1cc2nccnc2c(OCC2CNCCC2(F)F)n1
CN1CCNC[C@H]1COc1nc(cc2nccnc12)-c1cnn(C)c1 |r|
Cc1ccc(cc1)-c1cc2nccnc2c(NCCCCN)n1
Cn1cc(cn1)-c1cc2nccnc2c(OCC2CNCC(F)(F)C2)n1
COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(NC(=O)CN2CCOCC2)c1
FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|
Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
O=C(NC1CCCCC1)Nc1ccc(Nc2nccc(NC3CCCC3)n2)cc1
O=C(Cc1ccc(Nc2nccc(NC3CCCC3)n2)cc1)NC1CCCCC1
C1CCC(CC1)Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2nc[nH]c12
CC(O)(C#Cc1ccc(N2CCOCC2)c(Nc2ncnc3[nH]ccc23)c1)c1nccs1
Cc1noc(C)c1-c1cnc(N)c(Oc2ccc(cc2)C(=O)NC2CCCCC2)n1
Cc1noc(C)c1-c1cnc(N)c(Oc2ccc(cc2)C(=O)N2CCOCC2)n1
CN1CCN(CC1)C(=O)c1ccc(Oc2nc(cnc2N)-c2c(C)noc2C)cc1
Cc1noc(C)c1-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2ccccc2)n1
Cc1noc(C)c1-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2)n1
Cc1noc(C)c1-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2cccc(Cl)c2)n1
Cn1cc(cn1)-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2ccccc2)n1
Cn1cc(cn1)-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2)n1
Cn1cc(cn1)-c1cnc(N)c(Oc2ccc(cc2)C(=O)Nc2cccc(Cl)c2)n1
CCN(CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1)CCP(O)(O)=O
CCOC(=O)c1cnc2ccccc2c1Nc1cccc(c1)S(N)(=O)=O
CCOC(=O)c1cnc2ccc(Br)cc2c1Nc1cccc(c1)S(N)(=O)=O
CCOC(=O)c1cnc2ccc(C)cc2c1Nc1cccc(c1)S(N)(=O)=O
CCOC(=O)c1cnc2cc(Cl)cc(Cl)c2c1Nc1cccc(c1)S(N)(=O)=O
CCOC(=O)c1cnc2cc(Cl)cc(Cl)c2c1Nc1cccc(c1)S(=O)(=O)NC
CCOC(=O)c1cnc2ccccc2c1Nc1cccc(NS(C)(=O)=O)c1
CCOC(=O)c1cnc2ccc(Br)cc2c1Nc1cccc(NS(C)(=O)=O)c1
CCOC(=O)c1cnc2ccc(C)cc2c1Nc1cccc(NS(C)(=O)=O)c1
CCOC(=O)c1cnc2c(Cl)ccc(Cl)c2c1Nc1cccc(NS(C)(=O)=O)c1
FC(F)(F)c1cc(NC(=O)Nc2ccc(Nc3n[nH]c(=O)c4ccccc34)cc2)ccc1Cl
FC(F)(F)c1cccc(NC(=O)Nc2ccc(Nc3n[nH]c(=O)c4ccccc34)cc2)c1
FC(F)(F)c1cc(NC(=O)Nc2ccc(CCNc3n[nH]c(=O)c4ccccc34)cc2)ccc1Cl
FC(F)(F)c1cccc(NC(=O)Nc2ccc(CCNc3n[nH]c(=O)c4ccccc34)cc2)c1
Clc1ccc(NC(=O)Nc2ccc(CCNc3n[nH]c(=O)c4ccccc34)cc2)cc1
O=C(NC1CCCCC1)Nc1ccc(CCNc2n[nH]c(=O)c3ccccc23)cc1
FC(F)(F)c1cc(ccc1Cl)C(=O)Nc1ccc(CCNc2n[nH]c(=O)c3ccccc23)cc1
FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(CCNc2n[nH]c(=O)c3ccccc23)cc1
FC(F)(F)c1cccc(CC(=O)Nc2ccc(CCNc3n[nH]c(=O)c4ccccc34)cc2)c1
O=C(CC1CCCCC1)Nc1ccc(CCNc2n[nH]c(=O)c3ccccc23)cc1
O=C(Nc1ccc(CCNc2n[nH]c(=O)c3ccccc23)cc1)C1CCCCC1
COc1ccc(cc1)C(=O)Nc1c[nH]nc1-c1nc(c[nH]1)-c1ccc(CN2CCOCC2)cc1
[O-][N+](=O)c1ccc(cc1)C(=O)Nc1c[nH]nc1-c1nc(c[nH]1)-c1ccc(CN2CCOCC2)cc1
Clc1cccc(c1)C(=O)Nc1c[nH]nc1-c1nc(c[nH]1)-c1ccc(CN2CCOCC2)cc1
OC(=O)CSc1ncnc2cc(sc12)-c1cc2ccccc2s1
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4NCCCOc34)cc2)no1
CCC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccc2ncn(CCN3CCOCC3)c(=O)c2c1
CCC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccc2ncn(CCc3c[nH]c4ccccc34)c(=O)c2c1
CCCCNc1nc2ccc(cc2[nH]1)[N+]([O-])=O
CCCCNc1nc2cc(ccc2s1)[N+]([O-])=O
Cn1cc(cn1)-c1ccc2ncnc(Nc3cccc(NC(=O)Nc4ccc(F)cc4)c3)c2c1
Cn1cc(cn1)-c1ccc2ncnc(Nc3cccc(NC(=O)Nc4cccc(F)c4)c3)c2c1
CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(F)cc4)c3)ncnc2c1
CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(F)c4)c3)ncnc2c1
COc1ccc(cc1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(F)cc4)c3)ncnc2c1
COc1ccc(cc1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(F)c4)c3)ncnc2c1
Fc1ccc(NC(=O)Nc2cccc(Nc3ncnc4cc(ccc34)-c3cccs3)c2)cc1
Fc1cccc(NC(=O)Nc2cccc(Nc3ncnc4cc(ccc34)-c3cccs3)c2)c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(F)c(Cl)c4)c3)ncnc2c1
Cc1ccc(NC(=O)Nc2cccc(Nc3ncnc4cc(ccc34)-c3cnn(C)c3)c2)cc1F
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(F)cc4)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(F)c4)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccccc4F)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(Cl)c4)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(Cl)cc4)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(Br)c4)c3)ncnc2c1
COc1ccc(NC(=O)Nc2cccc(Nc3ncnc4cc(ccc34)-c3cnn(C)c3)c2)cc1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4ccc(cc4)C(C)(C)C)c3)ncnc2c1
CC(C)c1ccc(NC(=O)Nc2cccc(Nc3ncnc4cc(ccc34)-c3cnn(C)c3)c2)cc1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(c4)C(F)(F)F)c3)ncnc2c1
COc1ccc(cc1)C(=O)Nc1cccc(Nc2ncnc3cc(ccc23)-c2cnn(C)c2)c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)c4cccc(F)c4)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)c4cccc(Br)c4)c3)ncnc2c1
CC(C)c1ccc(NC(=O)c2cccc(Nc3ncnc4cc(ccc34)-c3cnn(C)c3)c2)cc1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(c3)C(=O)Nc3cccc(F)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(c3)C(=O)Nc3ccc(F)cc3)ncnc2c1
CCS(=O)(=O)Nc1ccc2c(c1)C(C(=O)N2)/C(=N/c3ccc(cc3)CN4CCCCC4)/c5ccccc5
CCNC(=O)C#Cc1ccc2\C(=C(\Nc3ccc(CN(C)C)cc3)c3ccccc3)C(=O)Nc2c1
Cn1cc(cn1)-c1ccc2c(Nc3cccc(N)c3)ncnc2c1
Cn1cc(cn1)-c1ccc2c(Nc3ccc(NC(=O)Nc4cccc(F)c4)cc3)ncnc2c1
CC(C)(C)c1cc(NC(=O)Cc2ccc(Nc3ncnc4[nH]c(cc34)-c3ccc(cc3)S(C)(=O)=O)cc2)no1
COc1cc(OC)c(F)c(N2Cc3cnc4[nH]c(cc4c3N(C)C2=O)-c2cnn(C)c2)c1F
Cn1cc(cn1)-c1cc2ncnc(Nc3ccc(CC(=O)Nc4cc(nn4C)C(C)(C)C)cc3)c2s1
c1cc(ncc1Cc2c[nH]c3c2cc(cn3)Cl)NCc4ccc(nc4)C(F)(F)F
COc1ccc(NC(=O)Nc2ccc(Oc3ncnc4cc(ccc34)N(C)C)cc2)cc1
CN(C)c1ccc2c(Oc3ccc(NC(=O)NCc4ccc(nc4)C(F)(F)F)cc3)ncnc2c1
CN(C)CCCOc1ccc2c(NCCc3cnc(NC(=O)Nc4cccc(Cl)c4)s3)ncnc2c1
COc1cc(cc2cnc(N)nc12)-c1ccc(O)cc1
CCc1c(F)c(O)ccc1-c1cc(OC)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(OC)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NC2CCN(CC2)C(C)=O)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NCCO)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(N(C)CCO)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NCCCO)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(N)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(N[C@H](C)CO)c2nc(N)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(NC[C@H](C)O)c2nc(N)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(NC[C@@H](C)O)c2nc(N)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(NC(CO)CO)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NCCNC)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NC2CCN(C)CC2)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(NCC2CCN(C)CC2)c2nc(N)ncc2c1
CCc1cc(O)c(F)cc1-c1cc(N[C@@H]2CCCN(C)C2)c2nc(N)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(N[C@H]2CCCN(C)C2)c2nc(N)ncc2c1 |r|
[H][C@]12CC[C@]([H])(C[C@@H](C1)Nc1cc(cc3cnc(N)nc13)-c1cc(F)c(O)cc1CC)N2 |r|
[H][C@]12CC[C@]([H])(C[C@H](C1)Nc1cc(cc3cnc(N)nc13)-c1cc(F)c(O)cc1CC)N2 |r|
CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCCN(C)C)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCOCCN(C)C)ncc2c1 |r|
CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCCCCN(C)C)ncc2c1 |r|
CCOc1cc2ncnc(NCCc3ccc(NC(=O)Nc4cc(ccc4OC)C(F)(F)F)cc3)c2cc1F
CCOc1cc2ncnc(NCCc3ccc(NC(=O)Nc4cc(Cl)ccc4OC)cc3)c2cc1F
CN1c2cc3ccccc3cc2C(=O)N(C)c2cnc(Nc3cnn(c3)C3CCNCC3)nc12
CN1CCN(Cc2ccc(Nc3ncc(Cl)c(Nc4ccccc4-c4n[nH]c(C)n4)n3)cc2)CC1
COc1c(Nc2cc(C)[nH]n2)nc(Sc2ccc(cc2F)S(=O)(=O)Cc2cccc(c2F)[N+]([O-])=O)nc1N1CCOCC1
c1cc(c2c(c1O)C(=O)C=CC2=O)O
Oc1cccc2C(=O)C=C(Cl)C(=O)c12 |t:8|
c1cc2c(c(c1)O)C(=O)C=CC2=O
CC1=C(Br)C(=O)c2ccccc2C1=O |c:1|
Oc1cc(CCl)c(O)c2C(=O)c3ccccc3C(=O)c12
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1cccnc1
CC(C)n1cc(Nc2ncc3ccc(=O)n(C(C)C)c3n2)cn1
CCOP(=O)(OCC)C(Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1)c1scnc1C
CCOP(=O)(OCC)C(Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1)c1ccn[nH]1
CCOP(=O)(OCC)C(Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1)c1ccc[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCN(Cc4ccc(Cl)cc4)CC3)c2[nH]1
Fc1ccc(NC(=O)N2CCCC2)cc1-c1ccn2c(cnc2n1)N1CCOCC1
O\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2c1cccc2Br
CC(=O)O\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2c1cccc2Br
CN1CCN(CC1)c2ccc(cc2)C(=O)Nc3c4c([nH]n3)CN(C4)C(=O)[C@@H](c5ccccc5)OC
Cc1nc(N)sc1-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
Cc1ccc(cc1)S(O)(=O)=O.Cc1ccsc1C(=O)Nc1cc(CN2CCN(CC2)C(=O)CO)ccc1\C=C\c1n[nH]c2ccccc12
Cn1c2ccccc2c3c1c4c(c5ccccc5n4CCC#N)c6c3C(=O)NC6
CNc1ncc2cc(ccc2n1)-c1cc(ccc1C)C(=O)Nc1cc(ccc1OC1CCN(C)CC1)C(F)(F)F
Cc1ccc(cc1-c1ccc2nc(NCCN3CCOCC3)ncc2c1)C(=O)Nc1cccc(c1)C(F)(F)F
OC(=O)c1cc(ccc1Cl)-c1ccc(\C=N\Nc2nc3nonc3nc2Nc2ccccc2)o1
NC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3)n2)cc1
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
COc1ccncc1NC(=O)c2ccnc(c2)NC(=O)C3CC3
O=C(Nc1cc(ccn1)C(=O)Nc1cnccc1-c1ccccc1)C1CC1
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
Clc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:13|
Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)N2CCN(N)CC2)n[nH]1
Cc1cc(Nc2ncc(C)c(n2)N2CCC(CC#N)CC2)sn1
Cc1cc(Nc2ncc(C)c(n2)N2CCN(CC#N)CC2)sn1
CC1CN(CCN1CC#N)c1nc(Nc2cc(C)ns2)ncc1C
C[C@H]1CN(CCN1CC#N)c1nc(Nc2cc(C)ns2)ncc1C |r|
Cc1cc(Nc2ncc(C)c(n2)N2CC3CCC(C2)N3CC#N)sn1 |TLB:20:19:15.16:12.13.18|
Cc1cc(Nc2ncc(C)c(n2)N2CC3CCC(C2)N3CCC#N)sn1 |THB:10:12:19:15.16|
Cc1cc(Nc2ncc(C)c(n2)N2CC3CCCC(C2)N3CC#N)sn1 |TLB:21:20:12.19.13:15.16.17,THB:10:12:20:15.16.17|
Cc1cc(Nc2ncc(C)c(n2)N2CC3CCCC(C2)N3CCC#N)sn1 |TLB:21:20:12.19.13:15.16.17|
Cc1cnc(Nc2cnn(C)c2)nc1N1CC2CCCC(C1)N2CC#N |TLB:23:22:14.21.15:17.18.19|
Cc1cnc(Nc2cnn(C)c2)nc1N1CC2CCCC(C1)N2CCC#N |TLB:23:22:17.18.19:14.21.15,THB:13:14:22:17.18.19|
Cc1cc(Nc2ncc(C)c(n2)N2CC(CCC#N)C2)sn1
Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)C2)sn1
Cc1cc(Nc2ncc(C)c(n2)N2CC(C2)C2CC2)sn1
Cc1cc(sn1)Nc2ncc(c(n2)N3CC(C3)(C4CC4)O)C
Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)(C2)OC2CC3(CC3)C2)sn1
Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)(C2)N2CCCC2)sn1
Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)(C2)N2CCCCC2)sn1
Cc1cc(sn1)Nc2ncc(c(n2)N3CC(C3)(CC#N)N4CCN(CC4)C)C
CN1CCN(CC1)C1(CC#N)CN(C1)c1nc(Nc2cnn(C)c2)ncc1C
Cc1cc(Nc2ncc(C)c(n2)-c2cnn(CCC#N)c2)sn1
Cc1cnc(Nc2cnn(C)c2)nc1-c1cnn(c1)[C@H](CC#N)C1CCCC1 |r|
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(Nc2ccc(cc2)C#N)n1
Fc1ccc(Nc2nccc(n2)C(=O)Nc2cnccc2-c2ccc(F)cc2)cc1
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1
CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2I |w:6.6,4.3|
CO\N=C1/C(/Nc2ccccc/12)=C1/C(=O)Nc2c1cccc2I
Oc1[nH]c2c(Br)cccc2c1C1=Nc2ccccc2C1=O |t:13|
Oc1[nH]c2c(F)cccc2c1-c1[nH]c2ccccc2c1N=O |(1.25,-3.26,;1.73,-1.79,;3.19,-1.31,;3.18,.22,;4.32,1.24,;5.79,.77,;4,2.75,;2.53,3.22,;1.4,2.19,;1.72,.7,;.82,-.55,;-.72,-.55,;-1.62,-1.82,;-3.11,-1.34,;-4.45,-2.11,;-5.79,-1.34,;-5.78,.21,;-4.45,.98,;-3.11,.22,;-1.63,.7,;-1.16,2.17,;-2.25,3.26,)|
Oc1[nH]c2c(Br)cccc2c1-c1[nH]c2ccccc2c1N=O |(-1.26,-17.11,;-.79,-15.64,;.68,-15.16,;.67,-13.63,;1.81,-12.6,;3.27,-13.08,;1.49,-11.1,;.02,-10.63,;-1.11,-11.66,;-.79,-13.15,;-1.69,-14.4,;-3.23,-14.4,;-4.14,-15.67,;-5.62,-15.19,;-6.96,-15.96,;-8.3,-15.19,;-8.3,-13.64,;-6.96,-12.87,;-5.63,-13.63,;-4.15,-13.15,;-3.67,-11.68,;-4.97,-10.17,)|
Oc1[nH]c2c(Cl)cccc2c1C1=Nc2ccccc2C1=O |t:13|
Oc1[nH]c2c(F)cccc2c1C1=Nc2ccccc2C1=O |t:13|
CO\N=C1/C(/Nc2ccccc/12)=C1/C(=O)Nc2c1cccc2F
CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2F |w:6.6,4.3|
Oc1[nH]c2c(Cl)cccc2c1-c1[nH]c2ccccc2c1N=O |(1.25,-3.25,;1.71,-1.79,;3.17,-1.31,;3.18,.23,;4.31,1.25,;5.78,.77,;3.99,2.75,;2.53,3.23,;1.39,2.2,;1.71,.71,;.81,-.54,;-.75,-.54,;-1.65,-1.79,;-3.12,-1.32,;-4.45,-2.1,;-5.79,-1.33,;-5.79,.22,;-4.46,.99,;-3.12,.22,;-1.66,.7,;-1.17,2.18,;-2.26,3.27,)|
CO\N=C1/C(=Nc2ccccc12)c1c(O)[nH]c2ccccc12 |c:4|
CO\N=C1/C(/Nc2ccccc/12)=C1/C(=O)Nc2c1cccc2Cl
CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2Cl |w:6.6,4.3|
CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2Br |w:6.6,4.3|
Oc1[nH]c2c(I)cccc2c1C1=Nc2ccccc2C1=O |t:13|
CC(=O)O\N=C1/C(=Nc2ccccc12)c1c(O)[nH]c2ccccc12 |c:6|
Oc1[nH]c2c(I)cccc2c1-c1[nH]c2ccccc2c1N=O |(26.57,-40.82,;27.04,-39.35,;28.5,-38.87,;28.49,-37.34,;29.64,-36.32,;31.1,-36.79,;29.32,-34.82,;27.85,-34.35,;26.72,-35.37,;27.04,-36.86,;26.14,-38.11,;24.6,-38.11,;23.69,-39.38,;22.21,-38.9,;20.87,-39.67,;19.53,-38.9,;19.53,-37.35,;20.87,-36.58,;22.2,-37.35,;23.68,-36.86,;24.15,-35.38,;23.11,-34.25,)|
CO\N=C1/C(/Nc2ccccc/12)=C1/C(=O)Nc2c1cccc2Br
Oc1[nH]c2ccccc2c1-c1[nH]c2ccccc2c1N=O |(1.71,2.82,;2.18,1.35,;3.65,.86,;3.62,-.68,;4.77,-1.7,;4.44,-3.2,;2.97,-3.66,;1.85,-2.62,;2.18,-1.13,;1.27,.12,;-.27,.12,;-1.18,-1.12,;-2.65,-.64,;-3.96,-1.41,;-5.29,-.64,;-5.29,.9,;-3.96,1.68,;-2.63,.9,;-1.16,1.38,;-.69,2.84,;-1.7,3.98,)|
O\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12
CCc1ccc2c(c1)c(=O)c(C(=O)Nc1ccc(Oc3ccnc4cc(OC)c(OC)cc34)c(F)c1)c(C)n2C
O=C(Nc1ccc(-c2ccc3c(c2)NC(=O)/C3=Cc2ccc[nH]2)cc1)NC1CC1
O=C1Nc2cc(-c3ccc(O)cc3)ccc2/C1=C/c1ccc[nH]1
Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(N3CCOCC3)nn2)c2ncn(C)c2n1
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cncc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
CN(C)c1ccc(cc1)-c1nc2ncc(Cl)c(N3CCN(CC(=O)Nc4nccs4)CC3)c2[nH]1
Cc1ccc(NC(=O)c2ccc3c(c2)c(CNCCc2ccc(-c4ccccc4)cc2)cn3C)cc1C
Cc1ccc(NC(=O)c2ccc3c(c2)c(CNCCN2CCNCC2)cn3C)cc1C
CCCNc1ccc2ncc(-c3ccc4[nH]ncc4c3)n2n1
Cn1nccc1-c1cc2c(Nc3ccc(OCc4ccccc4)cc3)ncnc2[nH]1
CCOc1cn(nc1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)c(F)c1)-c1ccc(F)cc1C
C[C@@H](C(F)(F)F)N(Cc1ccc(cc1)F)C(=O)CN2C(=O)[C@]3(CCc4c3ccc(c4)NC(=O)NC)OC2=O
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F
CCOC1=C(C(=O)N(C=C1)c2ccc(cc2)F)C(=O)Nc3ccc(c(c3)F)Oc4ccnc(c4Cl)N
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12 |r,wU:1.1,4.6,wD:1.0,(18.42,-37.26,;17.1,-36.49,;16.31,-37.82,;17.79,-35.11,;16.41,-34.42,;15.72,-35.8,;15.93,-32.97,;16.83,-31.71,;15.91,-30.47,;16.38,-29.01,;15.35,-27.88,;15.81,-26.41,;17.32,-26.08,;17.78,-24.62,;19.27,-24.29,;20.31,-25.42,;19.85,-26.89,;18.35,-27.21,;17.89,-28.68,;21.81,-25.09,;22.85,-26.23,;24.35,-25.9,;24.82,-24.43,;23.77,-23.29,;22.27,-23.63,;14.45,-30.96,;13.11,-30.19,;13.11,-28.65,;11.78,-30.96,;11.78,-32.51,;13.12,-33.28,;14.46,-32.5,)|
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CCc1cc(Nc2nccc(n2)-c2c(nc3ccccn23)-c2ccc(OC)c(c2)C(=O)Nc2c(F)cccc2F)c(OC)cc1N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
C[C@]1(CCCN1c1nc(Nc2cc([nH]n2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1 |r|
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1
CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3C(=O)O)N4CCOCC4
O=C(Nc1nc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)n2n1)C1CC1
CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc(C)n(C(C)C)c4c3)nc2)CC1
CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|
COc1cc2c3n([C@H](C)c4ccccn4)c(=O)[nH]c3cnc2cc1-c1c(C)noc1C |r,wD:7.7,(46.55,-39.62,;46.55,-41.16,;47.89,-41.93,;49.21,-41.16,;50.55,-41.92,;51.88,-41.15,;52.18,-39.65,;51.41,-38.32,;49.87,-38.32,;52.18,-36.98,;51.41,-35.66,;52.17,-34.32,;53.72,-34.32,;54.49,-35.66,;53.72,-36.99,;53.7,-39.47,;54.46,-38.13,;54.34,-40.87,;53.21,-41.9,;53.22,-43.46,;51.89,-44.23,;50.55,-43.47,;49.22,-44.25,;47.88,-43.47,;46.55,-44.24,;46.51,-45.79,;47.74,-46.72,;45.04,-46.23,;44.16,-44.97,;45.09,-43.74,;44.64,-42.27,)|
CN1CCN(CC1)C2CCN(CC2)c3ccc(c(c3)OC)Nc4ncc(c(n4)Nc5ccccc5P(=O)(C)C)Cl
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
C1[C@@H](NC2CCNCC2)[C@@H]1c1ccccc1 |r|
OC(=O)c1ccc(CN2CCC(CN[C@@H]3C[C@H]3c3ccccc3)CC2)cc1 |r|
CN1c2ccsc2C(=O)N(c3c1nc(nc3)Nc4ccc(cc4)S(=O)(=O)N)C
CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
Nc1ncnc2n(CC(=O)c3c[nH]c4ccccc34)cnc12
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1c[nH]c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1)c1cn(C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COC(C)(C)C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COc2ccccc2)c2ccccc12 |t:13|
COc1ccc(cc1)C1=C(C(=O)NC1)c1c[nH]c2ccccc12 |t:9|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1)c1c[nH]c2ccccc12 |t:13|
Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
COc1cc2nccc(Oc3ccc4c(NC(=O)c5cccc(c5)C(F)(F)F)nn(C)c4c3)c2cc1OC
Cc1cc(c2ccccc2c1Oc3c(cccn3)c4ccnc(n4)NC)Nc5[nH]c6ccccc6n5
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccccc3[nH]2)c2ccccc12
CCc1cc(Nc2nccc(n2)-c2c(nc3ccccn23)-c2cccc(c2)C(=O)Nc2c(F)cccc2F)c(OC)cc1N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
COc1cc(ccc1Nc1nccc(n1)-c1c(nc2ccccn12)-c1cccc(c1)C(=O)Nc1c(F)cccc1F)N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
CNc1cc(Nc2ccc(cc2)-c2nc3ccccc3s2)ccn1
COc1cc(Nc2ncnc3nc[nH]c23)ccc1-c1nc2ccccc2s1
CNC(=O)c1cc(Nc2ccc(cc2)-c2nc3ccccc3s2)ccn1
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2ccsc12
COc1cc(Nc2ncnc3ccsc23)ccc1-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)c2cc1OC
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)c2cc1OC
CNc1nc(Nc2ccc(cc2)-c2nc3ccccc3s2)c2cc(OC)c(OC)cc2n1
COc1cc2nc(Nc3cc(C)n[nH]3)nc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OC
Cc1cc(Nc2ccnc(Nc3ccc(cc3)-c3nc4ccccc4s3)n2)[nH]n1
COc1cc(Nc2nccc(Nc3cc(C)n[nH]3)n2)ccc1-c1nc2ccccc2s1
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2[nH]ccc12
COc1cc(Nc2ncnc3[nH]ccc23)ccc1-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(cc3)N3Cc4ccccc4C3)c2cc1OC
COc1nc(Nc2ccc(cc2)-c2nc3ccccc3s2)c2cc[nH]c2n1
Fc1cc(ccc1Nc1ncnc2cc(Cl)ccc12)-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OC
Cc1cc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1Cl
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OC
COc1cc2ncnc(Nc3ccc(cc3C)-c3nc4ccccc4s3)c2cc1OC
Clc1cc(Nc2ncnc3ccsc23)ccc1-c1nc2ccccc2s1
Cc1cc(Nc2cc(Nc3ccc(cc3)-c3nc4ccccc4s3)ccn2)[nH]n1
Fc1cc(ccc1Nc1ncnc2ccsc12)-c1nc2ccccc2s1
CNc1nccc(Nc2ccc(cc2)-c2nc3ccccc3s2)n1
Clc1ccc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ccnc2c1
CNc1ccnc(Nc2ccc(cc2)-c2nc3ccccc3s2)n1
COc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1-c1nc2ccccc2s1
Clc1ccc2c(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)ncnc2c1
CN(C)c1ccnc(Nc2ccc(cc2)-c2nc3ccccc3s2)n1
CN1CCN(CC1)c1ccnc(Nc2ccc(cc2)-c2nc3ccccc3s2)n1
Cc1cc(Nc2ccnc(Nc3cccc(c3)-c3nc4ccccc4s3)n2)[nH]n1
COc1cc2nc(Nc3cc(C)n[nH]3)nc(Nc3cccc(c3)-c3nc4ccccc4s3)c2cc1OC
N(c1cccc(c1)-c1nc2ccccc2s1)c1ncnc2[nH]ccc12
N(c1cccc(c1)-c1nc2ccccc2s1)c1ncnc2nc[nH]c12
COc1nc(Nc2ccc(-c3nc4ccccc4s3)c(OC)c2)c2cc[nH]c2n1
N(c1ccc(cc1)-c1nc2ccccc2s1)c1ncnc2nc[nH]c12
C[C@@H](Nc1c(Nc2ccncc2)c(=O)c1=O)c1ccccc1 |r|
NC(=O)C(Nc1c(Nc2ccncc2)c(=O)c1=O)c1ccccc1
NC(=O)C(Nc1c(Nc2ccncc2)c(=O)c1=O)c1cccc(O)c1
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccccc2F)c(=O)c1=O)c1ccccc1 |r|
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccsc2)c(=O)c1=O)c1ccccc1 |r|
C[C@@H](Nc1c(Nc2ccnc(c2)-c2ccco2)c(=O)c1=O)c1ccccc1 |r|
CC(=O)Nc1ccc(Sc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1
Cc1cc(Nc2nc(Sc3cccc(Cl)c3Cl)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)-c2ccccc2)cc1
CC(=O)Nc1ccc(Sc2nc(C)cc(Nc3cc(C)n[nH]3)n2)cc1
Cc1cc(Nc2nc(Sc3c(Cl)cccc3Cl)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)C2CC2)cc1
Cc1cc(Nc2nc(Sc3ccccc3Cl)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)C(C)(C)C)cc1
Cc1cc(Nc2nc(Sc3cccc(Cl)c3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)OC(C)(C)C)cc3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccccc3)nc3ccccc23)[nH]n1
CC(=O)Nc1ccc(Sc2nccc(Nc3cc(C)n[nH]3)n2)cc1
CCN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)CC)cc2)n1
Cc1cc(Nc2nc(Sc3ccc(Cl)c(Cl)c3)nc3ccccc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NS(C)(=O)=O)cc3)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)-c2ccncc2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCN(CC2)C2CC2)cc1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nc3ccccc23)[nH]n1
COc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1OC
CN(C(C)=O)c1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
Cc1cc(Nc2nc(Sc3ccc(Cl)cc3)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(C)cc(Nc3cc(C)n[nH]3)n2)cc1
Cc1cc(Nc2nc(Sc3ccc4ccccc4c3)nc3ccccc23)[nH]n1
CC(=O)Nc1ccc(Sc2nc(Nc3cc(n[nH]3)C3CC3)c3ccccc3n2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)-c2cccnc2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCC2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCN(C)CC2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCNCC2)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCN(CC2)C(C)(C)C)cc1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCOCC2)cc1
COc1ccccc1Sc1nc(Nc2cc(C)n[nH]2)c2ccccc2n1
Cc1cc(Nc2nc(Sc3ccc(Cl)cc3Cl)nc3ccccc23)[nH]n1
CCC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)N2CCCCC2)cc1
COc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)cc(n2)-c2ccccc2)cc1
CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)n[nH]3)c3ccccc3n2)cc1
COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COCCOc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
C[C@H](Nc1nc(Nc2cc(C)n[nH]2)cnc1C#N)c1ccc(F)cn1 |r|
C[C@H](Nc1nc(Nc2cc(C)n[nH]2)cnc1C#N)c1ncc(F)cn1 |r|
C[C@H](Nc1nc(Nc2cc(C)n[nH]2)c(C)nc1C#N)c1ncc(F)cn1 |r|
C[C@H](Nc1nc(Nc2cc(C)n[nH]2)c(C)nc1C#N)c1ccc(F)cn1 |r|
COc1cc(ccc1Nc1ncnc2cc(OCCCN3CCN(C)CC3)c(OC)cc12)-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3O)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1Nc1ncnc2cc(OC)c(OCCCN3CCN(C)CC3)cc12)-c1nc2ccccc2s1
COc1cc2c(Oc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3OC(F)(F)F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1Nc1ncnc2cc(OC)c(OC)cc12)-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(cc3O)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3O)-c3nc4ccccc4s3)c2cc1OC
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(F)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCCC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccc(F)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4cc(ccc4s3)C(F)(F)F)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4cc(Cl)ccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1-c1nc2ccccc2s1)N(C)c1ncnc2cc(OCCCN3CCN(C)CC3)c(OC)cc12
COc1cc2c(Nc3ccc(cc3F)-c3nc4ccc(Cl)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(F)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccc(Cl)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3C)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4cc(ccc4s3)C(F)(F)F)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4cc(Cl)ccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1ccc2nc(sc2c1)-c1ccc(Nc2ncnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)cc1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(C)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3F)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(cc3F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3C)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12
COc1c(O)cc2C(=O)Nc3cc4ccc(O)cc4c1c23
CC(=O)N1CCC(CC1)Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O
Cn1nc(C(N)=O)c2CCc3cnc(NC4CCN(CC4)C(=O)c4ccccc4)nc3-c12
CNC(=O)c1nn(C)c-2c1CCc1cnc(NC3CCN(CC3)C(=O)C3CCN(CC3)S(C)(=O)=O)nc-21
FC(F)(F)c1ccc2nc(Nc3ccc(CCNc4ncnc5ccsc45)nc3)[nH]c2c1
Cc1nc(Nc2ccc(CCNc3ncnc4ccsc34)cc2)[nH]c1C
Fc1cc(CCNc2ncnc3ccsc23)ccc1Nc1nc2ccc(cc2[nH]1)C(F)(F)F
C(Cc1ccc(Nc2nc(c[nH]2)-c2ccccc2)cc1)Nc1ncnc2ccsc12
Clc1ccc2nc(Nc3ccc(CCNc4ncnc5ccsc45)cc3)[nH]c2c1
FC(F)(F)c1cccc(Nc2nc3ccc(CCNc4ncnc5ccsc45)cc3[nH]2)c1
FC(F)(F)c1ccc2nc(Nc3ccc(CCNc4ncnc5ccsc45)cc3)[nH]c2c1
C(Cc1ccc(Nc2nc3ccccc3o2)cc1)Nc1ncnc2ccsc12
FC(F)(F)c1ccc2nc(Nc3ncc(CCNc4ncnc5ccsc45)s3)[nH]c2c1
C(Cc1cnc(Nc2nc3ccccc3[nH]2)s1)Nc1ncnc2ccsc12
Clc1cnc2nc(Nc3ccc(CCNc4ncnc5ccsc45)cc3)[nH]c2c1
FC(F)(F)c1cnc2nc(Nc3ccc(CCNc4ncnc5ccsc45)cc3)[nH]c2c1
FC(F)(F)c1ccc2nc(Nc3ccc(CCNc4ncnc5ccsc45)cn3)[nH]c2c1
C(Nc1ncnc2ccsc12)c1ccc(Nc2nc3ccccc3[nH]2)cc1
C(Cc1ccc(Nc2nc3ccccc3s2)cc1)Nc1ncnc2ccsc12
Cn1c(Nc2ccc(CCNc3ncnc4ccsc34)cc2)nc2ccccc12
C(Cc1cccc(Nc2nc3ccccc3[nH]2)c1)Nc1ncnc2ccsc12
C(Cc1ccc(Nc2nc3ccncc3[nH]2)cc1)Nc1ncnc2ccsc12
C(Nc1ncnc2ccsc12)c1cccc(Nc2nc3ccccc3[nH]2)c1
C(Cc1ccc(Nc2nc3ncccc3[nH]2)cc1)Nc1ncnc2ccsc12
C(Cc1ccc(Nc2nc3ccccc3[nH]2)cc1)Nc1ncnc2ccsc12
CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2c(C)ncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1
CN1C[C@@H]2C[C@H]1CN2c1ccc(cc1)-c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc(O)c1 |r|
CCCC(=O)Nc1n[nH]c2cc(ccc12)-c1ccc(O)cc1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)NCCO
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
Cn1cc(cn1)-c1ccnc2[nH]ccc12
CN(C)Cc1ccc(cc1)-c1cc2c(ccnc2[nH]1)-c1cnn(C)c1
c1cc2c(ccnc2[nH]1)-c1cn[nH]c1
CN(C)Cc1cccc(c1)-c1cc2c(ccnc2[nH]1)-c1cnn(C)c1
CN(C)Cc1ccc(cc1)-c1cc2c(-c3cnn(C)c3)c(Cl)cnc2[nH]1
CN(C)Cc1cccc(c1)-c1cc2c(-c3cnn(C)c3)c(Cl)cnc2[nH]1
[O-][N+](=O)c1cc2c(\C=C\c3ccccc3)n[nH]c2cc1N1CCCC1
Nc1cc2c(\C=C\c3ccccc3)n[nH]c2cc1N1CCCC1
CN1CCN(CC1)C(=O)Nc1cccc(\C=C\c2n[nH]c3cc(N4CCCC4)c(NS(C)(=O)=O)cc23)c1
Cc1cc2[nH]nc(\C=C\c3ccccc3)c2cc1NC(=O)Cc1cccs1
C1CCN(C1)c1cc2[nH]nc(\C=C\c3ccccc3)c2cc1-c1ccncc1
Cc1cc2[nH]nc(C#Cc3ccccc3)c2cc1NC(=O)Cc1cccs1
C(Nc1cc2c(\C=C\c3ccccc3)n[nH]c2cc1N1CCCC1)c1ccccn1
O=C(Cc1ccccc1)Nc1ccc2[nH]nc(C3CC3c3ccccc3)c2c1
CN1CCN(CC1)c1cc2[nH]nc(\C=C\c3ccccc3)c2cc1NCc1ccccn1
O=C(Cc1cccs1)Nc1cc2c(\C=C\c3ccccc3)n[nH]c2cc1N1CCCC1
CN1CCN(CC1)C(=O)Nc1cccc(\C=C\c2n[nH]c3cc(C)c(NC(=O)Cc4cccs4)cc23)c1
CN1CCN(Cc2cccc(\C=C\c3n[nH]c4cc(C)c(NC(=O)Cc5cccs5)cc34)c2)CC1
CN1CCN(Cc2cccc(\C=C\c3n[nH]c4ccc(C#N)c(C)c34)c2)CC1
CN1CCN(Cc2cccc(\C=C\c3n[nH]c4ccc(NC(=O)Cc5cccs5)cc34)c2)CC1
CN1CCN(Cc2cccc(\C=C\c3n[nH]c4ccc(-c5cc(C)cc(N)c5)c(C)c34)c2)CC1
CN1CCN(Cc2cccc(\C=C\c3n[nH]c4ccc(NC(=O)Cc5cccs5)c(C)c34)c2)CC1
COc1ccc(OC)c(CC(=O)Nc2cc3c(\C=C\c4ccccc4)n[nH]c3cc2C)c1
O=S(=O)(Cc1ccccc1)Nc1ccc2[nH]nc(\C=C\c3ccccc3)c2c1
O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COc1ccc(cc1Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O)N1CCN(C)CC1
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccncc3[nH]2)c2ccccc12
CNc1nccc(n1)c2cccnc2Oc3ccc(c4c3cccc4)Nc5[nH]c6cc(ccc6n5)C(F)(F)F
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)NC(C)(C)C)c2ccccc12
CCNC(=O)Nc1ccc(Oc2ncccc2-c2ccnc(NC)n2)c2ccccc12
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccccc3s2)c2ccccc12
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)Nc2ccccc2)c2ccccc12
CCN1CCC(CNc2nccc(n2)-c2cccnc2Oc2ccc(Nc3nc4ccccc4[nH]3)c3ccccc23)CC1
CN1CCCC1CCNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccccc3[nH]2)c2ccccc12
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccccc3o2)c2ccccc12
CN(C)CC(C)(C)CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nc3ccccc3[nH]2)c2ccccc12
CCNc1nc(C)c(s1)-c1ccnc(Nc2ccc(CNC(C)=O)cc2)n1
Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CNc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CCNc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CN(C)c1ccc(Nc2nccc(n2)-c2sc(C)nc2C)cc1
Cc1nc(N)sc1-c1ccnc(Nc2cccc(c2)[N+]([O-])=O)n1
CC(=O)N1CCN(CC1)c1ccc(Nc2nccc(n2)-c2sc(N)nc2C)cc1
COc1cc(Nc2nccc(n2)-c2sc(C)nc2C)cc(OC)c1OC
CC(=O)N1CCN(CC1)c1ccc(Nc2nccc(n2)-c2sc(C)nc2C)cc1
CNc1nc(C)c(s1)-c1ccnc(Nc2cc(OC)c(OC)c(OC)c2)n1
CNc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N2CCN(CC2)C(C)=O)n1
CCNc1nc(C)c(s1)-c1ccnc(Nc2cc(OC)c(OC)c(OC)c2)n1
Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)n1
CNc1ccc(Nc2nccc(n2)-c2sc(C)nc2C)cc1
CN(C)S(=O)(=O)c1ccc2NC(=O)C(=Cc3[nH]c4CCCC(=O)c4c3CCC(O)=O)c2c1 |w:14.14|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCc3ccccc23)[nH]c2CCCC(=O)c12 |w:7.6|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCCCC2)[nH]c2CCCC(=O)c12 |w:7.6|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCCC2)[nH]c2CCCC(=O)c12 |w:7.6|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:7.6|
CN(C)CCCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:8.7|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)Cc4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:7.6|
O=C(CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12)N1CCOCC1 |w:6.5|
O=C(CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12)N1CCCC1 |w:6.5|
CCOC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:9.8|
O=C(CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCc3ccccc23)[nH]c2CCCC(=O)c12)N1CCOCC1 |w:6.5|
CN(C)CCCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCc3ccccc23)[nH]c2CCCC(=O)c12 |w:8.7|
CNC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:8.7|
CCN(CC)CCCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:10.9|
O=C1Nc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=Cc1[nH]c2CCCC(=O)c2c1CCCN1CCCC1 |w:20.23|
CCN(CC)CCCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCc3ccccc23)[nH]c2CCCC(=O)c12 |w:10.9|
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(cc23)S(=O)(=O)N2CCOCC2)[nH]c2CCCC(=O)c12 |w:7.6|
COc1cc2c(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)ncnc2cc1OCCCN1CCC(CO)CC1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
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|
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Nc2ccccc2)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nnc(-c3ccc(F)cc3)c3ccccc23)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Nc2ccccc2)c(C)c1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Nc2ccc(F)cc2)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccc(Oc3ccccc3)cc2)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(Cl)c2)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(Oc3ccccc3)c2)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Nc2ccccc2)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cc(F)ccc2Nc2ccccc2)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nnc(-c3ccccc3)c3ccccc23)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Cl)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Oc2ccccc2)cc1C
O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCOCC3)c2s1 |r|
CS(=O)(=O)NCc1cccc(c1)c2cn3c(cnc3c(n2)Nc4ccc(cc4)N5CCOCC5)Cl
C[C@H]1CN(C[C@@H](C)O1)C1(CC1)c1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1 |r|
NC(=O)c1cc([nH]c1-c1ccccc1)-c1ccnc(N)n1
COc1ccc2cc([nH]c2c1)-c1n[nH]c2cccnc12
CCCc1cc(on1)-c1ccc2[nH]ncc2c1
C(c1cc(on1)-c1ccc2[nH]ncc2c1)c1ccccc1
Nc1n[nH]c2ccc(cc12)-c1cc(Cc2ccccc2)no1
C(N1CCCCC1)c1cc(on1)-c1ccc2[nH]ncc2c1
CNC(=O)c1cc(on1)-c1ccc2[nH]ncc2c1
C1CCC(C1)c1cn(nn1)-c1ccc2[nH]ncc2c1
OCCCc1cn(nn1)-c1ccc2[nH]ncc2c1
C1CC1c1cn(nn1)-c1ccc2[nH]ncc2c1
CCCc1cn(nn1)-c1ccc2[nH]ncc2c1
COCc1cn(nn1)-c1ccc2[nH]ncc2c1
c1[nH]nnc1-c1ccc2n[nH]cc2c1
C(c1ccccc1)n1cc(nn1)-c1ccc2[nH]ncc2c1
C(Cc1ccccc1)c1cn(nn1)-c1ccc2[nH]ncc2c1
C(Cc1cn(nn1)-c1ccc2[nH]ncc2c1)Cc1ccccc1
C(C1CCCCC1)c1cn(nn1)-c1ccc2[nH]ncc2c1
C(c1cn(nn1)-c1ccc2[nH]ncc2c1)c1ccccc1
Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Clc1ccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)cc1
Nc1n[nH]c2ccc(cc12)-c1cn(Cc2ccccc2)nn1
Clc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
Clc1cc(Cl)cc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Cc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Clc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1Cl
Fc1cccc(Cn2cc(nn2)-c2ccc3[nH]ncc3c2)c1
Fc1ccccc1Cn1cc(nn1)-c1ccc2[nH]ncc2c1
C(Nc1nc(c(s1)-c1ccccc1)-c1ccc2[nH]ncc2c1)c1ccccc1
C(Cc1ccccc1)Nc1nc(cs1)-c1ccc2[nH]ncc2c1
N(c1nc(c(s1)-c1ccccc1)-c1ccc2[nH]ncc2c1)c1ccccc1
c1n[nH]c2ccc(cc12)-c1nc2ncccn2c1-c1ccccc1
Cc1nc(cs1)-c1ccc2[nH]ncc2c1
c1n[nH]c2ccc(cc12)-c1cn2cccnc2n1
N(c1nc(cs1)-c1ccc2[nH]ncc2c1)c1ccccc1
C(Nc1nc(cs1)-c1ccc2[nH]ncc2c1)c1ccccc1
Nc1nc(cs1)-c1ccc2[nH]ncc2c1
CCNc1nc(cs1)-c1ccc2[nH]ncc2c1
Fc1ccc(cc1)-c1ncn(CCCN2CCOCC2)c1-c1ccc2[nH]ncc2c1
Fc1ccc(cc1)-c1ncn(C2CCN(Cc3ccccc3)C2)c1-c1ccc2[nH]ncc2c1
Fc1ccc(cc1)-c1ncn(CCN2CCOCC2)c1-c1ccc2[nH]ncc2c1
C1CCC(CC1)Nc1c(nc2ncccn12)-c1ccc2[nH]ncc2c1
CC(C)Nc1c(nc2ncccn12)-c1ccc2[nH]ncc2c1
C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccc2[nH]ncc2c1
C1CCC(CC1)Nc1c(nc2cnccn12)-c1ccc2[nH]ncc2c1
C1CCC(CC1)Nc1c(nc2sccn12)-c1ccc2[nH]ncc2c1
CN(C)CCn1cnc(c1-c1ccc2[nH]ncc2c1)-c1ccc(F)cc1
CCCCNc1c(nc2ncccn12)-c1ccc2[nH]ncc2c1
Clc1ccc(Nc2c(nc3ncccn23)-c2ccc3[nH]ncc3c2)cc1
Nc1n[nH]c2cc(ccc12)-c1ccnc(N)n1
C[C@H]1CC[C@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)[nH]nc2c1)NC(=O)OC(C)(C)C |r|
CNc1nc(cc(n1)-c1ccc2c(N)n[nH]c2c1)N1C[C@H](CC[C@H]1C)C(=O)NC1CCCCC1 |r|
CC(C)Nc1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
Nc1n[nH]c2cc(ccc12)-c1cc(NC2CCCC2)nc(N)n1
Nc1n[nH]c2cc(ccc12)-c1cc(Nc2ccccc2)nc(N)n1
CN(C)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCCC1
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCCCC1
C[C@@H]1COCCN1c1cc(nc(N)n1)-c1ccc2c(N)[nH]nc2c1 |r|
C[C@H]1COCCN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
CC[C@@H]1COCCN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
CC(C)[C@@H]1COCCN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
Nc1[nH]nc2cc(ccc12)-c1cc(nc(N)n1)N1CCO[C@@H](C1)C(=O)Nc1ccccc1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCO[C@H](C1)C(=O)Nc1ccccc1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCC[C@@H](C1)C(=O)Nc1ccccc1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCC[C@H](C1)C(=O)Nc1ccccc1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCC[C@@H](C1)C(=O)NC1CCCCC1 |r|
C[C@@H]1CC[C@@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)[nH]nc2c1)C(=O)Nc1ccccc1 |r|
C[C@H]1CC[C@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)Nc1ccccc1 |r|
C[C@@H]1CC[C@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)Nc1ccccc1 |r|
CNc1nc(cc(n1)-c1ccc2c(N)n[nH]c2c1)N1C[C@H](CC[C@H]1C)C(=O)Nc1ccccc1 |r|
C[C@@H]1CO[C@@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)Nc1ccccc1 |r|
CC[C@@H]1CO[C@@H](CN1c1cc(nc(NC)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)Nc1ccccc1 |r|
CNc1nc(cc(n1)-c1ccc2c(N)n[nH]c2c1)N1C[C@H](OC[C@H]1C)C(=O)NC1CCCCC1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCCC(C1)NC(=O)c1ccccc1
CC(C)(C)OC(=O)NC1CCCN(C1)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
CC(C)(C)OC(=O)N[C@H]1CCCN(C1)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
CC(C)(C)OC(=O)N[C@@H]1CCCN(C1)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
C[C@@H]1CC[C@@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)NC(=O)OC(C)(C)C |r|
C[C@@H]1C[C@H](CN(C1)c1cc(nc(N)n1)-c1ccc2c(N)[nH]nc2c1)NC(=O)OC(C)(C)C |r|
CNc1nc(cc(n1)-c1ccc2c(N)n[nH]c2c1)N1C[C@H](C)C[C@H](C1)N(C)C(=O)OC(C)(C)C |r|
Cc1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
CC(C)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)-c1ccccc1
CNc1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
C[C@@H]1CCCCN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1 |r|
Nc1n[nH]c2cc(ccc12)-c1cc(nc(N)n1)N1CCC[C@@H](C1)C(=O)NC1CCCC1 |r|
C[C@@H]1CC[C@@H](CN1c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)NC1CCCCC1 |r|
CC[C@@H]1CO[C@@H](CN1c1cc(nc(NC)n1)-c1ccc2c(N)n[nH]c2c1)C(=O)NC1CCCCC1 |r|
C[C@@H]1C[C@H](CN(C1)c1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1)N(C)C(=O)CC(C)(C)C |r|
COc1cc(nc(N)n1)-c1ccc2c(N)n[nH]c2c1
CCNc1cc(nc(N)n1)-c1ccc2c(N)[nH]nc2c1
Nc1[nH]nc2cc(ccc12)-c1cc(nc(N)n1)N1CCOCC1
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1
CC(CCCC(C)(C)O)Nc1nc(Nc2cc(C)n[nH]2)cc(C)c1C#N
CS(=O)(=O)N1CCC(CC1)c1cc(Nc2nccn3c(cnc23)-c2cn[nH]c2)sn1
O=S(=O)(N1CCOCC1)c1ccc(Nc2nccn3c(cnc23)-c2cn[nH]c2)cc1
Cc1cc(Nc2nc(SC(C)(C)C)cn3c(cnc23)-c2cn[nH]c2)sn1
Cc1cc(Nc2nc(Sc3ccc(F)cc3)cn3c(cnc23)-c2cn[nH]c2)sn1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C(=O)N2CCCC2)sn1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)S(C)=O)sn1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)S(C)(=O)=O)sn1
CCSc1cn2c(cnc2c(Nc2cc(C)ns2)n1)-c1cn[nH]c1
CN(C)CCSc1cn2c(cnc2c(Nc2cc(C)ns2)n1)-c1cn[nH]c1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)sn1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C#N)sn1
Cc1csc(Nc2nccn3c(cnc23)-c2cnn(C)c2)c1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)-c2cccnc2)sn1
Cc1cc(Nc2nccn3c(cnc23)-c2cnn(C)c2)sn1
Cc1cc(Nc2nc(CN3CCOCC3)cn3c(cnc23)-c2cn[nH]c2)sn1
CC(C)c1cc(Nc2nccn3c(cnc23)-c2cnn(C)c2)sn1
Cc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C(F)(F)F)sn1
Cn1cc(cn1)-c1cnc2c(Nc3cc(ns3)C3CCNCC3)nccn12
Cn1cc(cn1)-c1cnc2c(Nc3cc(ns3)C3CCN(CC3)S(C)(=O)=O)nccn12
Cc1cc(Nc2nc(CCN)cn3c(cnc23)-c2cn[nH]c2)sn1
Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
Cc1cc(O)cc2oc3cc(O)cc(O)c3c(=O)c12
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)Oc4ccccc4F)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)OC4CCCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](OC(C)(C)C)C(C4)N=O)cc3)nn3cccc23)n[nH]1 |r|
CC(C)O[C@H]1CN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C[C@@H]1O |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)OCC4CC4)cc3)nn3cccc23)n[nH]1 |r|
CCC(C)(C)O[C@H]1CN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C[C@@H]1O |r|
COCCO[C@H]1CN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C[C@@H]1O |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@@H](F)C4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)OC(C)(C)C(F)(F)F)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)Oc4cccc(F)c4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)Oc4ccc(F)cc4)cc3)nn3cccc23)n[nH]1 |r|
CN(C)CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)[nH]n3)c3cccn3n2)cc1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCC[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)OC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](O)[C@H](C4)Oc4ccc(F)cc4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)Oc4ccc(F)cc4F)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)[C@H](C4)Oc4cc(F)cc(F)c4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](O)C[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](N)C[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CCCC4)cc3)nn3cccc23)n[nH]1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](C[C@@H]4CO)OC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCOCC4)cc3)nn3cccc23)n[nH]1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](C[C@H]4CO)SC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
CN1CCN(CC1)C(=O)C(=O)Nc1cc2c(Nc3cc(C)n[nH]3)nc(Sc3ccc(NC(=O)C4CC4)cc3)nn2c1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H]5C[C@H]5[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CC4)cc3)nn3cccc23)n[nH]1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](C[C@H]4CO)Oc4ccc(F)cc4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCOCC4)cc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@H](F)C[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCC[C@@H]4CO)cc23)[nH]n1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCCC4)cc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](F)C[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cccc23)n[nH]1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4C[C@@H](C[C@H]4CO)OC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CCN4CCCCC4)cc23)[nH]n1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC(F)(F)C[C@H]4CO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3)c(c2)C(F)(F)F)n1)-c1cn[nH]c1
COc1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)ccc1C(=O)N1CCNCC1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3)c(c2)C2CC2)n1)-c1cn[nH]c1
Fc1cc(ccc1Nc1nc(cn2c(cnc12)-c1cn[nH]c1)C1CC1)C(=O)N1CCOCC1
Cc1cn2c(cnc2c(Nc2ccc(cc2F)C(=O)N2CCNCC2(C)C)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3C[C@@H]4CC[C@H](C3)N4)c(Cl)c2)n1)-c1cn[nH]c1 |r|
CC1(C)CNCCN1C(=O)c1ccc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)c(F)c1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)n1)-c1cn[nH]c1
CC1(C)CNCCN1C(=O)c1ccc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)cc1Cl
Cc1cn2c(cnc2c(Nc2ccc(cc2F)C(=O)N2CCNC(C)(C)C2)n1)-c1cn[nH]c1
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1CCNCC11CC1
CC1(C)CN(CCN1)C(=O)c1ccc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)c(F)c1
CC1(C)CN(CCN1)C(=O)c1ccc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)cc1Cl
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1CCNC2(CC2)C1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3)c(Cl)c2)n1)-c1cn[nH]c1
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1C[C@H]2CC[C@@H]1CN2 |r|
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1C[C@@H]2CC[C@H](C1)N2 |r|
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1CCOCC1
Cc1cn2c(cnc2c(Nc2ccc(cc2Cl)C(=O)N2CCNCC2)n1)-c1cn[nH]c1
Clc1cc(ccc1Nc1nc(cn2c(cnc12)-c1cn[nH]c1)C1CC1)C(=O)N1CCNCC1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3(C)C)c(Cl)c2)n1)-c1cn[nH]c1
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
Cc1cn2c(cnc2c(Nc2ccnc(c2)N2CCNCC2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(cc2Cl)C(=O)N2CCOCC2)n1)-c1cn[nH]c1
Clc1cc(ccc1Nc1nc(cn2c(cnc12)-c1cn[nH]c1)C1CC1)C(=O)N1CCOCC1
CCc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3)c(Cl)c2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(O)CC3)cs2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(cc2F)C(=O)N2CCNCC2)n1)-c1cn[nH]c1
Clc1cc(Nc2nc(cn3c(cnc23)-c2cn[nH]c2)C2CC2)ccc1C(=O)N1CCNCC1
Cc1cn2c(cnc2c(Nc2ccc(cc2)C(=O)N2CCNCC2)n1)-c1cn[nH]c1
Fc1cc(ccc1Nc1nc(cn2c(cnc12)-c1cn[nH]c1)C1CC1)C(=O)N1CCNCC1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC3)c(F)c2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(cc2F)C(=O)N2CCOCC2)n1)-c1cn[nH]c1
CCOc1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sc1C(=O)N1CCCC(C)C1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNCC33CC3)c(Cl)c2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNC(C)(C)C3)c(Cl)c2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3CCNC4(CC4)C3)c(Cl)c2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2ccc(C(=O)N3C[C@H]4CC[C@@H]3CN4)c(Cl)c2)n1)-c1cn[nH]c1 |r|
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cn[nH]c1
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@@H](O)CC[C@]12C |r|
CC(C)(CC(=O)NCCn1ccc2c1c(ncn2)Nc3ccc(c(c3)Cl)Oc4cccc(c4)C(F)(F)F)O
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc(cn2C)C(N)=O)c1
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc3c(CCNC3=O)n2C)c1
COc1cc2ncnc(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)c2cc1OC
COc1cccc(NC(=O)Cn2cc(Nc3ncnc4cc(OC)c(OC)cc34)cn2)c1
COc1cc2ncnc(Nc3cnn(CC(=O)Nc4ccc(cc4)N(C)C)c3)c2cc1OC
CC(C)n1c2CCCC(=O)c2c2C(=O)c3ccccc3-c12
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
COc1cc2ncnc(Nc3ccc(NC(=O)c4ccccc4)cc3)c2cc1OC
COc1cc2c(ccnc2cc1OC)Oc3ccc4c(c3)cccc4C(=O)NC5CC5
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)NC(C)C)c2cc1OC
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)NCC3CC3)c2cc1OC
COCCNC(=O)c1cccc2cc(Oc3ccnc4cc(OC)c(OC)cc34)ccc12
CNC(=O)c1cccc2cc(Oc3ccnc4cc(OC)c(OC)cc34)ccc12
CCNC(=O)c1cccc2cc(Oc3ccnc4cc(OC)c(OC)cc34)ccc12
COc1cc2c(ccnc2cc1OC)Oc3ccc4c(c3)cccc4C(=O)Nc5ccc(cc5)Cl
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)NC3CC3)c2cc1C(N)=O
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(N)=O)c2cc1C(N)=O
COCCNC(=O)c1cccc2cc(Oc3ccnc4cc(OC)c(cc34)C(N)=O)ccc12
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(N)=O)c2cc1OC
COc1cc2ncnc(Oc3ccc4c(cccc4c3)C(=O)NC3CC3)c2cc1OC
COc1ccc2c(Oc3ccc4c(cccc4c3)C(N)=O)ccnc2c1
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)NCC(F)(F)F)c2cc1OC
COc1cc2ncnc(Oc3ccc4c(cccc4c3)C(N)=O)c2cc1OC
COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)NC3(C)CC3)c2cc1OC
COCCNC(=O)c1cccc2cc(Oc3ncnc4cc(OC)c(OC)cc34)ccc12
COc1cc2c(Nc3cnc(NC(=O)c4ccccc4)nc3)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3nc(cs3)C(=O)Nc3ccccc3)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3ccc(s3)C(=O)Nc3ccccc3)ncnc2cc1OCCCN1CCOCC1
COc1cc2c(Nc3ncc(s3)C(=O)Nc3ccccc3)ncnc2cc1OCCCN1CCOCC1
Nc1ncnc2n[nH]c(Nc3ccc(F)cc3)c12
CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
CC1(C)CC(CC(C)(C)N1[O])NC(=O)c1cccc(c1)-c1cc2nccc(Nc3cccc(O)c3)n2n1 |^1:10|
CC(C)(C)C(=O)N1Cc2c(NC(=O)c3cc(F)cc(F)c3)[nH]nc2C1(C)C
CC(C)CC(=O)Nc1[nH]nc2c1CN(C(=O)C1CCN(C)CC1)C2(C)C
Cn1cc(c2c1ccc(c2)F)C3=C(C(=O)NC3=O)c4cccc(c4)NC[C@@H](CO)O
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
OCCCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
OCC(O)Cn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
OCCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1ccc(CN(C)C)cc1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nn(CC2CCCO2)cc1-c1ccnc2[nH]ccc12
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1cccc(CN(C)C)c1
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN2CCOCC2)cc1
FC(F)(F)Cn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCOCC2)c1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN(C)C)cc1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1cc(CN(C)C)ccc1C
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN(C)C)c1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(NC(C)=O)cc1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CN(C)C)cc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(NC(C)=O)c1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)C(=O)NCCN1CCN(C)CC1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nn(CC(=O)N2CCOCC2)cc1-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)C(=O)NCCCN1CCN(C)CC1
CCNC(=O)Cn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)C(=O)NCCN1CCOCC1
NC(=O)Cn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN2CCOCC2)cc1
CC(C)(C)n1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1ccc(CN2CCOCC2)cc1
CC(C)(C)n1ncc(c1-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCOCC2)c1
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCOCC2)c1
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN2CCCC2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1ccc(CN2CCCC2)cc1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCCC2)c1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN(C)C)cc1C
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CNCCS(C)(=O)=O)cc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CNCCN(C)C)cc12
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCCC2)c1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CNCCO)cc12
CCn1ncc(c1-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]ccc12
CCNC(=O)Nc1ccc(cc1)-c1nn(CC)cc1-c1ccnc2[nH]c(cc12)-c1cccc(CN2CCCC2)c1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1n[nH]cc1-c1ccnc2[nH]ccc12
CCn1cc(c(n1)-c1ccc(NC(=O)N(C)C)cc1)-c1ccnc2[nH]c(cc12)-c1ccc(CN(C)C)cc1
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CNCCCN3CCN(C)CC3)cc12
CCn1cc(c(n1)-c1ccc(NC(=O)Nc2ccccc2)cc1)-c1ccnc2[nH]c(CNCCN3CCOCC3)cc12
CN1CCN(CC1)c1nc2ncc(Br)c(N3CCN(Cc4cc(C)on4)CC3)c2[nH]1
COc1ccc(NC(=O)Nc2ccc3\C(=C\c4[nH]cc(C(O)=O)c4C)C(=O)Nc3c2)cc1
O=C1NCCc2[nH]c(cc12)-c1ccncc1
CC[N@](Cc1cc(sn1)Nc2c3ncc(n3cc(n2)C)c4c[nH]nc4)C(C)(C)CO
Cc1cn2c(cnc2c(Nc2cc(CN(CC(F)F)C(C)(C)CO)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN(CC(F)(F)F)C(C)(C)CO)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(F)(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CC(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CC(F)(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CNCCC(F)(F)F)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CNCC(F)(F)C(F)(F)F)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CC[C@@H](F)C3)ns2)n1)-c1cn[nH]c1 |r|
Cc1cn2c(cnc2c(Nc2cc(CN3CC(F)(F)C(F)(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCC(F)(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(CC3)C(F)(F)F)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCC3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CC[C@H](F)C3)ns2)n1)-c1cn[nH]c1 |r|
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(F)CC3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(F)(F)CC3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCC(F)C3)ns2)n1)-c1cn[nH]c1
Cc1cc(Nc2nn(CC(=O)c3ccc(cc3)C(F)(F)F)c(=O)c3ccccc23)[nH]n1
COc1ccc(cc1)C(=O)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
COc1cccc(c1)C(=O)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
Cc1cc(Nc2nn(-c3ccc(C)cc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(-c3cccc(C)c3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3csc(C)n3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2n[nH]c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(C)c(=O)c3ccccc23)[nH]n1
COc1ccc(cc1)-n1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
CC(C)n1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
CC(=O)Nc1ccc(Cn2nc(Nc3ccn[nH]3)c3ccccc3c2=O)cc1
Cc1cc(Nc2nn(Cc3cc(F)ccc3F)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(-c3ccc(F)cc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(-c3ccccc3)c(=O)c3ccccc23)[nH]n1
CC(C)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
Cc1cc(Nc2nn(-c3ccc(cc3)C(C)(C)C)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(CC(=O)c3ccccc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3ccccc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3ccc(F)cc3)c(=O)c3ccccc23)[nH]n1
COc1cccc(Cn2nc(Nc3cc(C)n[nH]3)c3ccccc3c2=O)c1
Cc1cc(Nc2nn(Cc3ccc(cc3)S(C)(=O)=O)c(=O)c3ccccc23)[nH]n1
COc1ccc(Cn2nc(Nc3cc(C)n[nH]3)c3ccccc3c2=O)cc1
Cc1cc(Nc2nn(-c3ccc(Cl)cc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3cccnc3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3cc(F)cc(F)c3)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(Cc3ccc(cc3)[N+]([O-])=O)c(=O)c3ccccc23)[nH]n1
Cc1cc(Nc2nn(CC(F)(F)F)c(=O)c3ccccc23)[nH]n1
CC(=O)Nc1ccc(Cn2nc(Nc3cc(C)n[nH]3)c3ccccc3c2=O)cc1
Cc1cc(Nc2nn(Cc3ccncc3)c(=O)c3ccccc23)[nH]n1
COc1ccccc1-c1nc2ncc(Br)c(NCC(O)CNC(=O)C3CCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(C(N)=O)c(NCCCNC(=O)C3CCCC3)c2[nH]1
NC(=O)c1cnc2nc([nH]c2c1NCCCNC(=O)C1CCC1)-c1ccc(OCCN2CCCCC2)cc1
Brc1cnc2nc([nH]c2c1NCCCNC(=O)C1CCC1)-c1ccc(OCCN2CCCCC2)cc1
COc1ccc(F)cc1-c1nc2ncc(Br)c(NCCCNC(=O)C3CCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C3CCCC3)c2[nH]1
Nc1cccc(c1)-c1nc2ncc(Br)c(NCCCNC(=O)C3CCC3)c2[nH]1
COc1cc(F)ccc1-c1nc2ncc(Br)c(NCCCNC(=O)C3CCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)c3ccccc3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C3CCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C3(CN)CC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C3CC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C(C)(C)C)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C3CC(O)C3)c2[nH]1 |(36.6,-30.43,;35.82,-29.1,;34.28,-29.11,;33.52,-30.45,;31.98,-30.46,;31.2,-29.13,;31.96,-27.8,;33.49,-27.78,;29.66,-29.14,;28.76,-30.39,;27.29,-29.92,;25.95,-30.7,;24.62,-29.93,;24.62,-28.39,;23.29,-27.62,;25.95,-27.62,;25.95,-26.08,;27.28,-25.3,;27.27,-23.76,;28.61,-23,;28.61,-21.46,;29.95,-20.69,;31.28,-21.46,;29.95,-19.15,;31.04,-18.07,;29.95,-16.98,;29.96,-15.44,;28.86,-18.06,;27.29,-28.38,;28.75,-27.9,)|
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCN(C)C(=O)C3CCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(=O)C(C)C)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCCCNC(C)=O)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(OCC3CCNCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(NCC3CCNCC3)c2[nH]1
COC[C@@H]1CCCN1C(=O)c1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1C |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@@H]1CO |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@H]1CN1CCOCC1 |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@@H]1CN1CCOCC1 |r|
COC[C@H]1CCCN1C(=O)c1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1C |r|
Cn1cc(Nc2ncc3cnn(C4C5CC6CC(C5)CC4C6)c3n2)cc1C(N)=O |THB:19:17:14:12.21.20,16:17:12:14.15.21,(-6.38,-15.11,;-7.29,-13.87,;-6.81,-12.4,;-8.06,-11.49,;-8.06,-9.95,;-6.73,-9.18,;-6.72,-7.63,;-5.39,-6.86,;-4.06,-7.63,;-2.59,-7.14,;-1.67,-8.38,;-2.58,-9.64,;-2.58,-11.18,;-3.92,-11.94,;-3.92,-13.48,;-2.58,-14.26,;-3.29,-13.44,;-2.59,-12.34,;-3.35,-12.69,;-2.07,-12.75,;-1.24,-11.94,;-1.25,-13.49,;-4.05,-9.17,;-5.39,-9.95,;-9.3,-12.39,;-8.83,-13.87,;-9.88,-15,;-11.39,-14.66,;-9.41,-16.47,)|
Cn1cc(Nc2ncc3cnn(C4CCCCCC4)c3n2)cc1C(N)=O
Cn1cc(Nc2ncc3cnn([C@H]4CC[C@H]5CCC[C@@H]45)c3n2)cc1C(N)=O |r|
Cn1cc(Nc2ncc3cnn(C4CCC5(CC5)CC4)c3n2)cc1C(N)=O
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(N)=O |r|
Cn1cc(Nc2ncc3cnn(C4CCC(C)(C)CC4)c3n2)cc1C(N)=O
CN(C)C(=O)[C@@H]1CCCN1C(=O)c1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1C |r|
Cn1cc(Nc2ncc3cnn([C@@H]4CC[C@H]5CCC[C@@H]45)c3n2)cc1C(N)=O |r|
CC(C)n1ncc2cnc(Nc3cc(C(N)=O)n(C)c3)nc12
C[C@@H]1CCCN1C(=O)c1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1C |r|
CNC[C@@H]1CCCN1C(=O)c1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1C |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@H]1C(N)=O |r|
Cn1cc(Nc2ncc3cnn(C4CCC5(CC5)C4)c3n2)cc1C(N)=O
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCCC1 |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@H]1CN1CCCC1 |r|
Cn1cc(Nc2ncc3cnn([C@H]4C[C@@H]5C[C@@H]5C4)c3n2)cc1C(=O)N1CCC[C@H]1CO |r|
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2ccccc2)c1
CN(C)CC#Cc1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(C)c2)cc1
Nc1ncc(-c2cnn(CCCN3CC[C@@H](O)C3)c2)c2scc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12 |r|
CNC(=O)\C=C\c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
CNC(=O)c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2ccoc2)c1
CCCn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2ccsc2)c1
CS(=O)(=O)CCn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cc[nH]c2)c1
Nc1ncc(-c2cnn(CCN3CCCCC3)c2)c2scc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cc[nH]n2)c1
CN1CCC(C1=O)n1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
Cc1ccccc1NC(=O)Nc1ccc(cc1)-c1csc2c(cnc(N)c12)-c1cnn(C)c1
C[C@@H](O)Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1 |r|
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2ccccc2)cc1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2ccccc2F)cc1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3ccnc(N)c23)c1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
COc1ccccc1NC(=O)Nc1ccc(cc1)-c1csc2c(cnc(N)c12)-c1cnn(C)c1
COc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(C)c2)cc1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(C)c2)c1
Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(c2)C(N)=O)cc1
CC(C)Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
CC(C)CCn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NC4C=CN(O)C=C4)c3)sn2)C1 |c:32,36|
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccccn4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccncc4)c3)sn2)C1
CC(C)CCNC(=O)Cn1cc(cn1)-c1cnc2c(Nc3cc(CN4CCCCC4)ns3)nc(C)cn12
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)NCc2cccc(F)c2F)c1
CN(C)C(=O)Cn1cc(cn1)-c1cnc2c(Nc3cc(CN4CCCCC4)ns3)nc(C)cn12
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)NCc2ccc(F)cc2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCCN(C)C)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4cccc(c4)C(F)(F)F)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)N2CCOCC2)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)NCc2cc(F)cc(F)c2)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2ccc(F)cc2)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2cccc(F)c2F)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2cc(F)cc(F)c2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4nccs4)c3)sn2)C1
CNC(=O)Cn1cc(cn1)-c1cnc2c(Nc3cc(CN4CCCCC4)ns3)nc(C)cn12
COc1cccc(CNC(=O)Cn2cc(cn2)-c2cnc3c(Nc4cc(CN5CCCC(C)C5)ns4)nc(C)cn23)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NN4CC=CC=N4)c3)sn2)C1 |c:33,35|
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccccc4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)N(C)Cc4ccccc4)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)NCc2cccc(F)c2)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)NCc2ccccc2F)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(Cc2nc(c[nH]2)-c2ccccc2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4cccs4)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2ccccc2F)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2cccc(F)c2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4cccnc4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4cccc(F)n4)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(Cc2noc(n2)-c2ccccc2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4cccnc4F)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(O)=O)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(N)=O)c1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(O)=O)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4cccnc4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccncc4O)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4ccccc4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(Cc4nc5ccccc5[nH]4)c3)sn2)C1
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(Cc2nc(no2)-c2ccccc2)c1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4cccc(c4)N(C)C)c3)sn2)C1
COc1ccc(CNC(=O)Cn2cc(cn2)-c2cnc3c(Nc4cc(CN5CCCC(C)C5)ns4)nc(C)cn23)cc1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4ccc(cc4)C(F)(F)F)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4ncco4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4ccco4)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccncc4F)c3)sn2)C1
CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4ccncc4)c3)sn2)C1
CN(C)S(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(CN3CCN(C)CC3)cc2)ncc1Cl
COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC
CC1=C(C(=O)N(N1C)c2ccccc2)C(=O)Nc3ccc(c(c3)F)Oc4ccnc5c4cc(c(c5)OC)OC
COc1ccc2c(Oc3ccc(NC(=O)c4c(C)n(CC(C)(C)O)n(-c5ccccc5)c4=O)nc3)ccnc2c1
CC(O)c1cc2cnc(Nc3cc(C(=O)N4CCN(C)CC4)n(C)c3)nc2n1C1CCCC1
CNCc1cc2cnc(Nc3cc(C(=O)N4CCN(C)CC4)n(C)c3)nc2n1C1CCCC1
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(C(O)=O)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(CO)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4cnn(C)c4)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4cnco4)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4cncn4C)n(C4CCCC4)c3n2)cn1C
CC(C)CCn1cc(cn1)-c1cc2cnc(Nc3cc(C(=O)N4CCN(C)CC4)n(C)c3)nc2n1C1CCCC1
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4cnn(C)c4C)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4cnn(Cc5ccccc5)c4)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(-c4ccnn4C)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(CN=O)n(C4CCCC4)c3n2)cn1C
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3cc(C#N)n(C4CCCC4)c3n2)cn1C
Cn1cc(cc1C(=O)N2CCN(CC2)C)Nc3ncc4cc(n(c4n3)C5CCCC5)C(=O)N
CN1CCN(CC1)C(=O)c1cc(Nc2ncc3ccn(C4CCCC4)c3n2)cn1C
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
Cn1c(nc2ccccc12)-c1ccc2c(n1)n(C)c(=O)n(C)c2=O
COc1ccc(Nc2ncc3CC(=O)Nc4ccccc4-c3n2)cc1O
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccccc2)n1
Cc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(Cl)cc2)n1
Cn1c(nc2ccccc12)-c1ccnc(Nc2cccc(O)c2)n1
COc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1O
CCOc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
COc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(O)cc2)n1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(O)c(Cl)c2)n1
CC(C)(N)C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc5sncc45)c(Cl)c3)c12
Cc1cc(ccc1Nc2nc3c(c(n2)NC4CCCCC4)[nH]cn3)N5CCOCC5
NCc1cccc(NC(=O)c2cccc3onc(N)c23)c1
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(F)c(F)c4)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(cc4)C(F)(F)F)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4cccc(F)c4)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CC(=O)Nc4cccc(F)c4)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNS(=O)(=O)c4ccccc4)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Cc4cccc(F)c4)c3)c12
Nc1n[nH]c2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(F)c(F)c4)c3)c12
Nc1n[nH]c2cccc(C(=O)Nc3cccc(CNC(=O)Nc4cccc(F)c4)c3)c12
Nc1nsc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(F)c(F)c4)c3)c12
Nc1nsc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(cc4)C(F)(F)F)c3)c12
Nc1nsc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4cccc(F)c4)c3)c12
Nc1noc2cccc(C(=O)Nc3ccc(NC(=O)Nc4ccc(F)cc4)cc3)c12
Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
Nc1ncnn2ccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(cc4)C(F)(F)F)c3)c12
Nc1noc2cccc(C(=O)Nc3ccc(NC(=O)Nc4ccccc4)cc3)c12
Nc1ncnn2ccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(Cl)cc4)c3)c12
Cn1nc(N)c2c(cccc12)C(=O)Nc1cccc(CNC(=O)Nc2ccc(cc2)C(F)(F)F)c1
Cn1nc(N)c2c(cccc12)C(=O)Nc1cccc(CNC(=O)Nc2cccc(F)c2)c1
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccccc4)c3)c12
Nc1noc2cccc(C(=O)Nc3ccc(NC(=O)Nc4ccc(Cl)cc4)cc3)c12
Cc1ccc(NC(=O)Nc2ccc(NC(=O)c3cccc4onc(N)c34)cc2)cc1
Cc1ccc(NC(=O)NCc2cccc(NC(=O)c3ccn4ncnc(N)c34)c2)cc1
Nc1ncnn2ccc(C(=O)Nc3cccc(CNC(=O)Nc4cccc(Cl)c4)c3)c12
Nc1ncnn2ccc(C(=O)Nc3cccc(CNC(=O)Nc4cccc(F)c4)c3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccccc4F)c3)c12
Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccsc4)cc3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(Cl)cc4)c3)c12
Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)NC4CCCC4)cc3)c12
Cc1ccc(NC(=O)NCc2cccc(NC(=O)c3cccc4onc(N)c34)c2)cc1
Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccc(F)cc4)cc3)c12
Nc1noc2cccc(C(=O)Nc3cccc(CNC(=O)Nc4ccc(F)cc4)c3)c12
Cc1cccc(NC(=O)Nc2ccc(NC(=O)c3ccn4ncnc(N)c34)cc2)c1
Cn1cc(Nc2ncc(c(N[C@@H]3[C@H]4CC[C@H](C4)[C@@H]3C(N)=O)n2)C(F)(F)F)cn1 |r|
Cn1cc(Nc2ncc(c(N[C@H]3C[C@@H]4CC[C@H]3C4)n2)C(F)(F)F)cn1 |r|
Cn1cc(Nc2ncc(c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(=O)NC3CC3)n2)C(F)(F)F)cn1 |r,c:15|
Cn1cc(Nc2ncc(c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(=O)NCCO)n2)C(F)(F)F)cn1 |r,c:15|
Cn1cc(Nc2ncc(c(N[C@@H]3[C@@H]4C[C@H](C[C@@H]3C(N)=O)C4(C)C)n2)C(F)(F)F)cn1 |r|
CNC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(C)c2)ncc1C(F)(F)F |r,c:8|
Cn1cc(Nc2ncc(Cl)c(N[C@H]3[C@H]4CC[C@H](C4)[C@H]3C(N)=O)n2)cn1 |r|
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C(N)=O)n2)cn1 |r|
Cn1cc(Nc2ncc(c(Nc3ccccc3C(N)=O)n2)C(F)(F)F)cn1
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@H]4CC[C@H](C4)[C@@H]3C(N)=O)n2)cn1 |r|
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:16|
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3CCC[C@@H]3C(N)=O)n2)cn1 |r|
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3CC[C@@H]3C(N)=O)n2)cn1 |r|
Cn1cc(Nc2ncc(Cl)c(N[C@@H]3CCCC[C@@H]3C(N)=O)n2)cn1 |r|
CCn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:17|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(Cc3ccccc3)c2)ncc1Cl |r,c:7|
CN1CCN(CC1)c1ccc(Nc2ncc(F)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cc1C |c:24|
Cc1cnc(Nc2cnn(C)c2)nc1N[C@@H]1[C@@H]2C[C@@H](C=C2)[C@@H]1C(N)=O |r,c:21|
NC(=O)Cn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:19|
COc1cnc(Nc2cnn(C)c2)nc1N[C@@H]1[C@@H]2C[C@@H](C=C2)[C@@H]1C(N)=O |r,c:22|
CNC(=O)Cn1cc(Nc2ncc(Cl)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:20|
Cn1cc(Nc2ncc(F)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:16|
Cn1cc(Nc2nccc(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:15|
Cn1cc(Nc2ncc(c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)C(F)(F)F)cn1 |r,c:15|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(c2)[C@@H]2CCCNC2)ncc1Cl |r,c:7|
Cn1cc(Nc2ncc(Br)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:16|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(C[C@H]3CCCN3)c2)ncc1Cl |r,c:7|
Cn1cc(Nc2ncc(C(N)=O)c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)cn1 |r,c:18|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(CCN3CCOCC3)c2)ncc1Cl |r,c:7|
Cn1cc(Nc2ncc(c(N[C@@H]3[C@@H]4C[C@@H](C=C4)[C@@H]3C(N)=O)n2)[N+]([O-])=O)cn1 |r,c:15|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(c2)C2CCNCC2)ncc1Cl |r,c:7|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(CCO)c2)ncc1Cl |r,c:7|
NC(=O)[C@H]1[C@H]2C[C@H](C=C2)[C@H]1Nc1nc(Nc2cnn(CC(O)=O)c2)ncc1Cl |r,c:7|
CC(C)(C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc(Cl)c4)c(Cl)c3)c12)S(C)(=O)=O
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1C
COCCO[C@@H]1CCN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)OCCN4CCOCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@@H](O)C4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)OCCO)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCC(F)(F)C4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](O)C4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NCC(F)(F)F)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCOCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NCCN4CCOCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCC(O)CC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)OC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
CN1CCN(CCO[C@@H]2CCN(CC(=O)Nc3ccc(Sc4nc(Nc5cc(C)[nH]n5)c5cccn5n4)cc3)C2)CC1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)OCCCN4CCOCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)Nc4ccc(F)cc4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC4CCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC4CCCC4)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCC(C4)C(=O)C(C)(C)C)cc3)nn3cccc23)n[nH]1
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)NS(C)(=O)=O)cc3)nn3cccc23)n[nH]1 |r|
CC(C)C(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)SC(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)S(=O)(=O)C(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)S(=O)C(C)(C)C)cc3)nn3cccc23)n[nH]1 |r|
Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1 |r|
Nc1ncnc2scc(-c3ccc(NC(=O)Cc4cc(F)ccc4F)cc3)c12
Nc1ncc(-c2cccnc2)c2scc(-c3ccc4N(CCc4c3)C(=O)Cc3ccccc3)c12
Cn1cc(-c2ccc3N(CCc3c2)C(=O)Cc2cccc(c2)C(F)(F)F)c2c(N)ncnc12
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
CC(C)(C#N)Oc1cccc(c1Cl)C(=O)Nc2cc(ccc2F)N(C)c3ccc4c(n3)sc(n4)NC(=O)C5CC5
O=C(NCCCNc1nc(Nc2ccc(cc2)N2CCOCC2)ncc1C1CC1)C1CCC1
Cn1cc(Nc2ncc(C3CC3)c(NCCCNC(=O)C3CCC3)n2)cn1
CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Cc1cccc(Nc2nc(OCCN)ncc2C(N)=O)c1
Cc1cccc(Nc2nc(N[C@H]3CCCNC3)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCCNC3)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@H]3CCCC[C@H]3N)ncc2C(N)=O)c1 |r|
c1cc(cc(c1)Nc2c(cnc(n2)N3CCC[C@@H](C3)N)C(=O)N)C(F)(F)F
Cc1cccc(Nc2nc(N[C@@H]3COCC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCOC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCC(F)(F)C[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3COC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(NCCN)ncc2C(N)=O)c1
Cc1cccc(Nc2nc(N[C@@H]3CC(F)(F)CC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1ccc(cc1)Nc2c(cnc(n2)N[C@@H]3CCOC[C@@H]3N)C(=O)N
Cc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)ncc2C(N)=O)cc1 |r|
COc1ccc(Nc2nc(N[C@@H]3CCOC[C@@H]3N)ncc2C(N)=O)cc1 |r|
Cc1cccc(Nc2nc(N[C@H]3CCNC3)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(NC[C@@H]3CCCN3)ncc2C(N)=O)c1 |r|
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(O)c(Br)c3)cc(Br)c2O)N=O)cc1Br
Oc1ccc2CCNC(=O)C(Cc3cc(Br)c(Oc4cc(CC(N=O)C(=O)NCCc5cc(Br)c(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O
Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O |w:29.29|
Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(Oc4cc(CC(N=O)C(=O)NCCc5cc(Br)c(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(Oc3ccc(CCNC(=O)C(Cc4cc(Br)c(O)c(c4)-c4cc(CC(N=O)C(=O)NCCc5ccc(O)c(Br)c5)cc(Br)c4O)N=O)cc3Br)c2)N=O)cc1Br
FC(F)(F)c1cc(NC(=O)Nc2ccc(Oc3ncnc4n[nH]cc34)cc2)ccc1Cl
CN1c2ccc(NCc3ccc(cc3)C(C)(C)C)cc2-c2c(cnn2C)S1(=O)=O
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(C)c3-c2c1
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3c[nH]nc3-c2c1
[O-][N+](=O)c1ccccc1-c1n[nH]cc1C=C1C(=O)Nc2ccccc12 |w:14.15|
c1cc(c2ccsc2c1)Oc3ccc(cc3Cl)Nc4c5c(ncn4)NCCC(=C5)C(=O)NCCO
COc1cccc(F)c1C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1ccc(C(=O)Nc2ccc(Nc3ccnc4[nH]c(=O)c5ccccc5c34)cc2)c(c1)C(F)(F)F
c1ccc(cc1)C(=O)Nc2ccc(cc2)Nc3ccnc4c3-c5ccccc5C(=O)N4
Fc1c(cccc1C(F)(F)F)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1cc(F)cc(c1)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1ccc(cc1F)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1cccc(F)c1C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1ccc(C(=O)Nc2ccc(Nc3ccnc4[nH]c(=O)c5ccccc5c34)cc2)c(F)c1
Fc1cccc(C(=O)Nc2ccc(Nc3ccnc4[nH]c(=O)c5ccccc5c34)cc2)c1F
FC(F)(F)c1ccc(cc1)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1ccc(cc1)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Cc1ccc(cc1)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1cccc(c1)C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
FC(F)(F)c1ccccc1C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Fc1ccccc1C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
COc1ccccc1C(=O)Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
O=C(Nc1ncc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cn1)c1ccccc1
O=C(Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)nc1)c1ccccc1
O=C(Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cn1)c1ccccc1
Nc1ccc(Nc2ccnc3[nH]c(=O)c4ccccc4c23)cc1
Clc1ccnc2[nH]c(=O)c3ccccc3c12
CCN(CC)Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(n1)S(C)(=O)=O
Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(n1)S(C)(=O)=O
CS(=O)(=O)c1nc(Cl)cc(Nc2c[nH]nc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)n1
CCN(CC)Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
CCN(CC)Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(SC)n1
CCN(CC)Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(C)n1
CSc1nc(Cl)cc(Nc2c[nH]nc2-c2nc3ccc(C)cc3[nH]2)n1
Cc1ccc2nc([nH]c2c1)-c1n[nH]cc1Nc1cc(Cl)nc(C)n1
Clc1cc(Nc2c[nH]nc2-c2nc3ccc(CN4CCCCC4)cc3[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Clc1cc(Nc2c[nH]nc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
CSc1nc(Cl)cc(Nc2c[nH]nc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)n1
Cc1nc(Cl)cc(Nc2c[nH]nc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)n1
CN(C)CCOc1ccc(cc1)c2cc3c(ncnc3o2)NCCc4ccc(cc4)NC(=O)Nc5ccccc5
c1ccc(cc1)NC(=O)Nc2ccc(cc2)CCNc3c4cc(oc4ncn3)c5ccc(cc5)OCCN6CCC(CC6)O
CC(=O)NCCNc1ccc(cc1C#N)[N+]([O-])=O
C[C@@H](Oc1c(N)ncc2c(coc12)C1=CCN(CC1)C(N)=O)c1c(Cl)ccc(F)c1Cl |r,t:15|
COc1ccc2NC(=O)\C(=C\c3ccc4c(\C=C\c5ccc(nc5)N5CCN(C)CC5)n[nH]c4c3)c2c1
Cc1c(cnn1C)-c1cnc(N)c2oc(cc12)-c1csc2cnccc12
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(c(oc12)-c1cccc2nnsc12)-c1cccnc1 |r,wU:13.14,wD:10.10,(-9.96,-23.67,;-8.48,-23.2,;-7.35,-24.23,;-5.89,-23.75,;-5.57,-22.25,;-4.09,-21.78,;-3.62,-20.31,;-2.08,-20.31,;-1.61,-21.78,;-2.85,-22.68,;-.15,-22.25,;.18,-23.77,;1.64,-24.25,;2.79,-23.22,;4.25,-23.7,;2.47,-21.71,;1,-21.23,;-6.71,-21.23,;-6.7,-19.69,;-8.16,-19.21,;-9.08,-20.46,;-8.17,-21.7,;-8.65,-17.74,;-7.6,-16.61,;-8.07,-15.14,;-9.56,-14.81,;-10.61,-15.96,;-12.15,-15.95,;-12.64,-17.42,;-11.39,-18.33,;-10.14,-17.42,;-5.47,-18.79,;-4.06,-19.42,;-2.82,-18.51,;-2.97,-16.98,;-4.38,-16.35,;-5.63,-17.26,)|
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(Cl)c(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(28,-9.67,;29.47,-9.2,;30.61,-10.23,;32.07,-9.75,;32.39,-8.26,;33.86,-7.78,;34.33,-6.31,;35.87,-6.31,;36.35,-7.78,;35.1,-8.68,;37.81,-8.25,;38.13,-9.77,;39.58,-10.25,;40.73,-9.22,;42.2,-9.7,;40.42,-7.71,;38.95,-7.23,;31.26,-7.23,;31.25,-5.69,;32.5,-4.79,;29.79,-5.22,;28.89,-6.46,;29.79,-7.7,;29.32,-3.75,;30.36,-2.61,;29.89,-1.15,;28.39,-.82,;27.35,-1.96,;25.81,-1.96,;25.33,-3.42,;26.58,-4.33,;27.82,-3.43,)|
COc1nn(C)cc1-c1cnc(N)c2oc(cc12)-c1csc2cnccc12
Cc1nn(C)cc1-c1cnc(N)c2oc(cc12)-c1csc2cnccc12
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(C#N)c(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(47.34,-10.13,;48.81,-9.66,;49.94,-10.69,;51.41,-10.21,;51.72,-8.71,;53.19,-8.24,;53.67,-6.77,;55.21,-6.77,;55.68,-8.24,;54.44,-9.14,;57.15,-8.71,;57.46,-10.23,;58.92,-10.71,;60.07,-9.68,;61.53,-10.16,;59.75,-8.17,;58.28,-7.69,;50.59,-7.69,;50.59,-6.15,;51.83,-5.25,;53.07,-4.34,;49.13,-5.68,;48.22,-6.92,;49.13,-8.16,;48.66,-4.21,;49.7,-3.07,;49.23,-1.61,;47.72,-1.28,;46.69,-2.42,;45.15,-2.42,;44.67,-3.88,;45.91,-4.79,;47.16,-3.89,)|
Cn1cc(cn1)-c1cnc(N)c2oc(cc12)-c1csc2cnccc12
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(C(F)F)c(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(47.16,-24.66,;48.63,-24.19,;49.76,-25.22,;51.23,-24.74,;51.55,-23.24,;53.01,-22.77,;53.49,-21.3,;55.03,-21.3,;55.51,-22.77,;54.26,-23.67,;56.97,-23.24,;57.28,-24.76,;58.74,-25.24,;59.89,-24.21,;61.35,-24.69,;59.57,-22.7,;58.1,-22.22,;50.41,-22.22,;50.41,-20.68,;51.66,-19.77,;53.06,-20.4,;51.5,-18.24,;48.95,-20.2,;48.04,-21.45,;48.95,-22.69,;48.48,-18.74,;49.52,-17.6,;49.05,-16.14,;47.55,-15.81,;46.51,-16.95,;44.97,-16.95,;44.49,-18.41,;45.73,-19.32,;46.98,-18.42,)|
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(-c3cncs3)c(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(9.62,-24.57,;11.08,-24.1,;12.22,-25.13,;13.69,-24.65,;14,-23.16,;15.47,-22.68,;15.95,-21.22,;17.49,-21.22,;17.96,-22.68,;16.72,-23.59,;19.43,-23.16,;19.74,-24.67,;21.2,-25.15,;22.35,-24.12,;23.81,-24.61,;22.03,-22.62,;20.56,-22.13,;12.87,-22.13,;12.87,-20.59,;14.12,-19.69,;14.12,-18.15,;15.58,-17.67,;16.49,-18.92,;15.58,-20.16,;11.4,-20.12,;10.5,-21.37,;11.41,-22.6,;10.94,-18.65,;11.98,-17.52,;11.51,-16.05,;10,-15.72,;8.96,-16.86,;7.42,-16.86,;6.95,-18.33,;8.19,-19.23,;9.44,-18.33,)|
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2c(CF)c(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(28.58,-24.18,;30.05,-23.7,;31.18,-24.73,;32.65,-24.26,;32.97,-22.76,;34.43,-22.29,;34.91,-20.82,;36.45,-20.82,;36.92,-22.28,;35.68,-23.19,;38.39,-22.76,;38.7,-24.28,;40.16,-24.75,;41.31,-23.73,;42.77,-24.21,;40.99,-22.22,;39.52,-21.74,;31.83,-21.74,;31.83,-20.2,;33.08,-19.29,;32.91,-17.76,;30.37,-19.72,;29.46,-20.97,;30.37,-22.21,;29.9,-18.26,;30.94,-17.12,;30.47,-15.65,;28.96,-15.32,;27.93,-16.47,;26.39,-16.47,;25.91,-17.93,;27.15,-18.84,;28.4,-17.93,)|
Nc1ncc(-c2cnn(c2)[C@H]2CC[C@H](O)CC2)c2cc(oc12)-c1cccc2nnsc12 |r,wU:13.14,wD:10.10,(9.91,-9.17,;11.37,-8.7,;12.51,-9.73,;13.97,-9.25,;14.29,-7.76,;15.76,-7.28,;16.23,-5.82,;17.77,-5.82,;18.25,-7.28,;17,-8.19,;19.71,-7.76,;20.03,-9.27,;21.48,-9.75,;22.63,-8.72,;24.1,-9.21,;22.32,-7.22,;20.85,-6.73,;13.16,-6.73,;13.16,-5.19,;11.69,-4.72,;10.79,-5.97,;11.69,-7.2,;11.22,-3.25,;12.26,-2.12,;11.8,-.65,;10.29,-.32,;9.25,-1.47,;7.71,-1.46,;7.23,-2.93,;8.48,-3.83,;9.72,-2.93,)|
CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)CC1
CCc1ccc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2c1 |r,wU:25.26,wD:22.22,(34.44,-4.96,;33.51,-3.74,;31.98,-3.93,;31.04,-2.71,;29.52,-2.9,;28.92,-4.33,;27.47,-4.83,;27.5,-6.37,;26.29,-7.31,;26.32,-8.85,;25,-9.64,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;26.37,-11.93,;27.69,-11.14,;29.03,-11.88,;30.36,-11.09,;31.7,-11.84,;33.02,-11.06,;33,-9.52,;34.33,-8.73,;31.66,-8.77,;30.34,-9.56,;27.67,-9.6,;28.98,-6.82,;29.86,-5.55,;31.38,-5.35,)|
CCc1ccc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2n1 |r,wU:25.26,wD:22.22,(34.44,-4.96,;33.5,-3.74,;31.98,-3.93,;31.04,-2.71,;29.52,-2.9,;28.92,-4.33,;27.47,-4.83,;27.5,-6.37,;26.29,-7.31,;26.32,-8.85,;25,-9.64,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.36,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;26.37,-11.93,;27.69,-11.14,;29.03,-11.88,;30.36,-11.09,;31.7,-11.84,;33.02,-11.06,;33,-9.52,;34.33,-8.73,;31.66,-8.77,;30.34,-9.56,;27.67,-9.6,;28.98,-6.82,;29.86,-5.55,;31.38,-5.35,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Cc2ccccc2)cc(Nc2nc3cccnc3s2)n1 |r,wU:1.0,wD:4.7,(34.33,-8.73,;33,-9.52,;33.02,-11.06,;31.7,-11.84,;30.36,-11.09,;30.34,-9.56,;31.66,-8.77,;29.03,-11.88,;27.69,-11.14,;26.37,-11.93,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.36,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;25,-9.64,;26.32,-8.85,;26.29,-7.31,;27.5,-6.37,;27.47,-4.83,;28.92,-4.33,;29.52,-2.9,;31.04,-2.71,;31.98,-3.93,;31.38,-5.35,;29.86,-5.55,;28.98,-6.82,;27.67,-9.6,)|
COc1ccc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2n1 |r,wU:25.26,wD:22.22,(34.29,-5.26,;33.51,-3.93,;31.98,-3.93,;31.04,-2.71,;29.52,-2.9,;28.92,-4.33,;27.47,-4.83,;27.5,-6.37,;26.29,-7.31,;26.32,-8.85,;25,-9.64,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;26.37,-11.93,;27.69,-11.14,;29.03,-11.88,;30.36,-11.09,;31.7,-11.84,;33.02,-11.06,;33,-9.52,;34.33,-8.73,;31.66,-8.77,;30.34,-9.56,;27.67,-9.6,;28.98,-6.82,;29.86,-5.55,;31.38,-5.35,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Cc2ccccc2)cc(Nc2nc3ccc(cc3s2)C#N)n1 |r,wU:1.0,wD:4.7,(23.68,-13.98,;22.35,-14.78,;22.37,-16.32,;21.05,-17.1,;19.71,-16.35,;19.69,-14.81,;21.01,-14.02,;18.39,-17.14,;17.04,-16.39,;15.72,-17.18,;14.38,-16.44,;13.04,-17.23,;11.71,-16.46,;11.71,-14.92,;10.38,-14.14,;9.04,-14.92,;9.04,-16.46,;10.38,-17.22,;14.35,-14.9,;15.67,-14.1,;15.65,-12.56,;16.85,-11.63,;16.82,-10.09,;18.27,-9.58,;18.87,-8.16,;20.4,-7.96,;21.33,-9.19,;20.73,-10.61,;19.2,-10.8,;18.33,-12.08,;22.85,-8.99,;24.37,-8.8,;17.02,-14.86,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Cc2ccccc2)cc(Nc2nc3ccc(cc3s2)C(F)(F)F)n1 |r,wU:1.0,wD:4.7,(34.33,-8.73,;33,-9.52,;33.02,-11.06,;31.7,-11.84,;30.36,-11.09,;30.34,-9.56,;31.66,-8.77,;29.03,-11.88,;27.69,-11.14,;26.37,-11.93,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;25,-9.64,;26.32,-8.85,;26.29,-7.31,;27.5,-6.37,;27.47,-4.83,;28.92,-4.33,;29.52,-2.9,;31.04,-2.71,;31.98,-3.93,;31.38,-5.35,;29.86,-5.55,;28.98,-6.82,;33.51,-3.74,;34.44,-4.96,;34.1,-2.32,;35.04,-3.73,;27.67,-9.6,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Cc2ccccc2)cc(Nc2nc3ccc(Cl)cc3s2)n1 |r,wU:1.0,wD:4.7,(34.33,-8.73,;33,-9.52,;33.02,-11.06,;31.7,-11.84,;30.36,-11.09,;30.34,-9.56,;31.66,-8.77,;29.03,-11.88,;27.69,-11.14,;26.37,-11.93,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;25,-9.64,;26.32,-8.85,;26.29,-7.31,;27.5,-6.37,;27.47,-4.83,;28.92,-4.33,;29.52,-2.9,;31.04,-2.71,;31.98,-3.93,;33.51,-3.74,;31.38,-5.35,;29.86,-5.55,;28.98,-6.82,;27.67,-9.6,)|
Cc1ccc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2c1 |r,wU:24.25,wD:21.21,(33.51,-3.74,;31.98,-3.93,;31.04,-2.71,;29.52,-2.9,;28.92,-4.33,;27.47,-4.83,;27.5,-6.37,;26.29,-7.31,;26.32,-8.85,;25,-9.64,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;26.37,-11.93,;27.69,-11.14,;29.03,-11.88,;30.36,-11.09,;31.7,-11.84,;33.02,-11.06,;33,-9.52,;34.33,-8.73,;31.66,-8.77,;30.34,-9.56,;27.67,-9.6,;28.98,-6.82,;29.86,-5.55,;31.38,-5.35,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Cc2ccccc2)cc(Nc2nc3ccccc3s2)n1 |r,wU:1.0,wD:4.7,(34.33,-8.73,;33,-9.52,;33.02,-11.06,;31.7,-11.84,;30.36,-11.09,;30.34,-9.56,;31.66,-8.77,;29.03,-11.88,;27.69,-11.14,;26.37,-11.93,;25.03,-11.18,;23.69,-11.97,;22.36,-11.2,;22.37,-9.66,;21.03,-8.89,;19.69,-9.66,;19.69,-11.2,;21.03,-11.97,;25,-9.64,;26.32,-8.85,;26.29,-7.31,;27.5,-6.37,;27.47,-4.83,;28.92,-4.33,;29.52,-2.9,;31.04,-2.71,;31.98,-3.93,;31.38,-5.35,;29.86,-5.55,;28.98,-6.82,;27.67,-9.6,)|
Cc1cc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2cc1C |r,wU:23.24,wD:20.20,(13.06,-1.23,;12.47,-2.65,;10.94,-2.85,;10.35,-4.27,;8.9,-4.77,;8.93,-6.32,;7.72,-7.25,;7.75,-8.8,;6.43,-9.59,;6.45,-11.13,;5.12,-11.92,;3.79,-11.15,;3.79,-9.61,;2.46,-8.83,;1.12,-9.6,;1.12,-11.14,;2.45,-11.91,;7.8,-11.87,;9.12,-11.08,;10.46,-11.83,;11.79,-11.04,;13.13,-11.79,;14.45,-11.01,;14.43,-9.46,;15.76,-8.67,;13.09,-8.71,;11.76,-9.5,;9.09,-9.55,;10.41,-6.76,;11.28,-5.49,;12.81,-5.29,;13.4,-3.88,;14.93,-3.68,)|
Cc1cnc(Nc2cc(Cc3ccccc3)nc(N[C@H]3CC[C@H](O)CC3)n2)s1 |r,wU:22.23,wD:19.19,(57.53,-16.46,;56.01,-16.27,;55.28,-14.93,;53.76,-15.22,;53.57,-16.74,;52.23,-17.49,;52.2,-19.03,;50.85,-19.77,;50.82,-21.31,;49.48,-22.06,;48.11,-21.34,;46.81,-22.18,;45.44,-21.47,;45.37,-19.93,;46.67,-19.1,;48.04,-19.8,;52.14,-22.11,;53.49,-21.36,;54.81,-22.16,;54.78,-23.7,;53.43,-24.44,;53.4,-25.98,;54.73,-26.78,;54.7,-28.32,;56.07,-26.03,;56.1,-24.49,;53.52,-19.82,;54.97,-17.41,)|
COc1ccc2nc(Nc3cc(Cc4ccccc4)nc(N[C@H]4CC[C@H](O)CC4)n3)sc2c1 |r,wU:25.26,wD:22.22,(39.46,-21.76,;38.71,-20.41,;37.17,-20.38,;36.42,-19.04,;34.89,-19.01,;34.11,-20.32,;32.6,-20.62,;32.41,-22.14,;31.06,-22.88,;31.04,-24.42,;29.69,-25.17,;29.66,-26.7,;28.32,-27.45,;26.94,-26.74,;25.65,-27.57,;24.28,-26.86,;24.21,-25.33,;25.51,-24.5,;26.87,-25.2,;30.98,-27.5,;32.32,-26.75,;33.65,-27.55,;33.62,-29.09,;32.27,-29.83,;32.24,-31.37,;33.56,-32.17,;33.53,-33.71,;34.9,-31.42,;34.93,-29.88,;32.35,-25.21,;33.8,-22.8,;34.85,-21.67,;36.38,-21.7,)|
COc1ccc2nc(Nc3cc(nc(N[C@H]4CC[C@H](O)CC4)n3)C(F)(F)c3ccc(F)cc3)sc2c1 |r,wU:18.18,wD:15.14,(40.74,-21.58,;39.99,-20.23,;38.45,-20.2,;37.7,-18.85,;36.17,-18.83,;35.39,-20.14,;33.88,-20.44,;33.69,-21.95,;32.34,-22.7,;32.31,-24.24,;30.96,-24.98,;30.93,-26.52,;32.26,-27.32,;33.61,-26.57,;34.93,-27.37,;34.9,-28.91,;33.55,-29.65,;33.52,-31.19,;34.84,-31.98,;34.81,-33.52,;36.19,-31.24,;36.21,-29.7,;33.64,-25.03,;29.59,-27.26,;28.4,-28.25,;30.69,-28.36,;28.22,-26.55,;26.93,-27.39,;25.56,-26.68,;25.49,-25.14,;24.12,-24.43,;26.79,-24.31,;28.15,-25.01,;35.08,-22.61,;36.13,-21.48,;37.66,-21.51,)|
NC(=O)[C@@H]1CCCN1c1nc(Nc2ncc(Cc3ccccc3)s2)cc(n1)C(F)(F)c1ccc(F)cc1 |r|
O[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ncc(Cc3ccccc3)s2)cc(n1)C(F)(F)c1ccc(F)cc1 |r,wU:1.0,wD:4.7,(16.64,-34.58,;16.67,-33.04,;15.34,-32.24,;15.37,-30.7,;16.72,-29.96,;18.04,-30.75,;18.01,-32.29,;16.75,-28.42,;15.43,-27.62,;15.46,-26.08,;14.14,-25.29,;14.17,-23.75,;15.51,-23,;15.7,-21.49,;17.21,-21.19,;17.96,-22.54,;19.49,-22.73,;20.42,-21.5,;21.94,-21.69,;22.87,-20.46,;22.27,-19.04,;20.73,-18.86,;19.81,-20.09,;16.91,-23.66,;12.79,-26.03,;12.76,-27.57,;14.08,-28.37,;11.42,-28.31,;10.23,-29.3,;12.4,-29.5,;10.05,-27.6,;8.75,-28.44,;7.38,-27.73,;7.31,-26.19,;5.94,-25.48,;8.61,-25.36,;9.97,-26.06,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(Oc3ccc(F)cc3)cn2)cc(n1)C(F)(F)c1ccc(F)cc1 |r,wU:1.0,wD:4.7,(28.55,-32.78,;28.57,-31.24,;27.25,-30.44,;27.28,-28.9,;28.63,-28.16,;29.95,-28.95,;29.92,-30.49,;28.66,-26.62,;27.34,-25.82,;27.37,-24.28,;26.05,-23.49,;26.07,-21.95,;27.38,-21.13,;28.74,-21.86,;30.05,-21.04,;30,-19.5,;31.31,-18.68,;32.67,-19.4,;32.71,-20.94,;34.07,-21.66,;35.38,-20.85,;36.74,-21.57,;35.32,-19.3,;33.96,-18.58,;28.63,-18.77,;27.32,-19.59,;24.69,-24.24,;24.67,-25.77,;25.99,-26.57,;23.33,-26.52,;22.13,-27.5,;24.3,-27.7,;21.96,-25.81,;20.66,-26.64,;19.29,-25.93,;19.22,-24.4,;17.85,-23.69,;20.52,-23.56,;21.88,-24.27,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Nc2cc3ccccc3cn2)cc(n1)C(F)(F)c1ccc(F)cc1 |r,wU:1.0,wD:4.7,(43.15,-16.86,;43.18,-15.32,;41.86,-14.53,;41.89,-12.99,;43.24,-12.24,;44.55,-13.04,;44.52,-14.57,;43.27,-10.7,;41.95,-9.91,;41.97,-8.37,;40.65,-7.57,;40.68,-6.03,;41.99,-5.22,;43.35,-5.94,;44.66,-5.12,;46.01,-5.85,;47.32,-5.03,;47.26,-3.49,;45.91,-2.77,;44.61,-3.58,;43.23,-2.86,;41.93,-3.68,;39.3,-8.32,;39.28,-9.86,;40.6,-10.65,;37.93,-10.6,;36.74,-11.58,;38.91,-11.79,;36.57,-9.89,;35.27,-10.72,;33.9,-10.01,;33.83,-8.48,;32.46,-7.77,;35.13,-7.65,;36.49,-8.35,)|
O[C@H]1CC[C@@H](CC1)Nc1nc(Nc2n[nH]c3ccccc23)cc(n1)C(F)(F)c1ccc(F)cc1 |r,wU:1.0,wD:4.7,(44.56,-17.27,;44.59,-15.73,;43.27,-14.93,;43.3,-13.39,;44.65,-12.65,;45.96,-13.44,;45.94,-14.98,;44.68,-11.11,;43.36,-10.32,;43.39,-8.78,;42.06,-7.98,;42.09,-6.44,;43.4,-5.62,;44.83,-6.2,;45.82,-5.02,;45.01,-3.71,;45.43,-2.24,;44.37,-1.13,;42.87,-1.5,;42.44,-2.98,;43.51,-4.09,;40.71,-8.73,;40.69,-10.27,;42.01,-11.06,;39.35,-11.01,;38.15,-11.99,;40.32,-12.19,;37.98,-10.3,;36.68,-11.13,;35.31,-10.42,;35.24,-8.89,;33.87,-8.18,;36.54,-8.06,;37.9,-8.76,)|
CS(=O)(=O)N1CCOC(CNc2nc(Cc3ccccc3)cc(Nc3cc(n[nH]3)-c3ccco3)n2)C1
NC(=O)C1CCN1c1nc(Cc2ccccc2)cc(Nc2cc(n[nH]2)C2CCC2)n1
Cc1csc(Nc2cc(Cc3ccccc3)nc(N[C@H]3CC[C@H](O)CC3)n2)n1 |r,wU:22.23,wD:19.19,(55.81,-14.87,;55.16,-16.26,;55.9,-17.61,;54.85,-18.74,;53.45,-18.07,;52.11,-18.82,;52.09,-20.36,;50.73,-21.1,;50.71,-22.64,;49.36,-23.39,;47.99,-22.67,;46.7,-23.51,;45.33,-22.8,;45.26,-21.26,;46.55,-20.44,;47.92,-21.13,;52.03,-23.44,;53.37,-22.69,;54.69,-23.49,;54.67,-25.03,;53.31,-25.77,;53.29,-27.31,;54.61,-28.11,;54.58,-29.65,;55.95,-27.36,;55.98,-25.82,;53.4,-21.15,;53.65,-16.56,)|
COc1ccc2nc(Nc3cc(nc(n3)N3CCC[C@H]3C(N)=O)C(F)(F)c3ccc(F)cc3)sc2c1 |r|
COc1ccc2c(n1)sc(n2)Nc3cc(nc(n3)NC4CCC(CC4)O)C(c5ccc(cc5)F)(F)F
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC3(CC2)OCCO3)cc1
CC(C)Nc1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)c2cc(on2)c3c(cc(cc3Oc4ccc(cc4)[N+](=O)[O-])O)O
Cc1cc(NC(=O)c2ccc(Oc3c(Cl)cnc4nc([nH]c34)-c3cn(C)nc3C)cc2)on1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)Nc3ccccc3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)NC3CCC3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)Nc3cccnc3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)Nc3ccncc3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Nc3ccc(cc3)C(=O)Nc3ccccc3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)N3CCCC3)c2[nH]1
Cc1nn(C)cc1-c1nc2ncc(Cl)c(Oc3ccc(cc3)C(=O)NCc3ccccc3)c2[nH]1
CN(Cc1ccccc1)c1c(Cl)cnc2nc([nH]c12)-c1cn(C)nc1C
CN(C[C@H]1CCCN(C1)c1c(Cl)cnc2nc([nH]c12)-c1cn(C)nc1C)S(C)(=O)=O |r|
Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCC[C@@H](CNS(C)(=O)=O)C3)c2[nH]1 |r|
Cc1nn(C)cc1-c1nc2ncc(Cl)c(N3CCC[C@H](CNS(C)(=O)=O)C3)c2[nH]1 |r|
CC(=O)NC[C@@H]1CCN(C1)c1c(Cl)cnc2nc([nH]c12)-c1cn(C)nc1C |r|
CC(=O)N[C@@H]1CCN(C1)c1c(Cl)cnc2nc([nH]c12)-c1cn(C)nc1C |r|
CC(=O)N[C@H]1CCN(C1)c1c(Cl)cnc2nc([nH]c12)-c1cn(C)nc1C |r|
COc1ccc(cc1)-c1[nH]c2ncc(Cl)cc2c1-c1cccc(CNC(C)=O)c1
CC(=O)NCc1cccc(c1)-c1c([nH]c2ncc(Cl)cc12)-c1cnn(C)c1
COc1ccc(cc1)-c1[nH]c2ncc(Cl)cc2c1-c1cccc(CNS(C)(=O)=O)c1
Cn1cc(cn1)-c1[nH]c2ncc(Cl)cc2c1-c1cccc(CNS(C)(=O)=O)c1
Cc1c(O)c(O)c2oc(cc2c1C=O)-c1c(C)c(O)c(O)c(O)c1C=O
Cc1c2COC(=O)c2c(O)c(O)c1O
COCc1c(C)c(O)c(O)c(O)c1C=O
COC1OC(=O)c2c1c(C)c(O)c(O)c2O
Cc1c(O)c(O)c2O[C@H]3O[C@H](C(=O)c4c(O)c(O)c(O)c(C)c34)c2c1C=O |r|
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cncn1C
CN(C)C1CCN(CC1)C(=O)c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cnn(C)c2)c(Cl)c1
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1c(C)noc1C
C(CN1CCOCC1)Oc1ccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)cc1
C(c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)cc1)n1cccn1
CN(C)S(=O)(=O)c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)cc1
Cn1cc(cn1)-c1cc2cnc(Nc3ccc(cc3Cl)C(=O)N3CCS(=O)(=O)CC3)cc2[nH]1
COC1CCN(CC1)C(=O)c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cnn(C)c2)c(Cl)c1
CN(C)S(=O)(=O)c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cnn(C)c2)c(Cl)c1
COc1cc(ccc1Nc1cc2[nH]c(cc2cn1)-c1cnn(C)c1)C(=O)N(C)C
CN(C)C(=O)c1ccc(Nc2cc3[nH]c(cc3cn2)-c2cnn(C)c2)c(Cl)c1
Cn1cc(cn1)-c1cc2cnc(Nc3ccccc3Cl)cc2[nH]1
COc1ccc(cc1Nc1cc2[nH]c(cc2cn1)-c1cnn(C)c1)C(F)(F)F
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cnco1
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cnn(C)c1C
COc1ccc(Nc2cc3[nH]c(cc3cn2)-c2cn(C)nc2C(F)(F)F)c(OC)c1
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cnn(c1)C(F)F
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cnn(CC(F)(F)F)c1
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cnn(C)c1
COc1ccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)c(Cl)c1
Clc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cn[nH]c1
CCOc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cn[nH]c1
COc1ccccc1Nc1cc2[nH]c(cc2cn1)-c1cn[nH]c1
COC(=O)c1cc(O)c(O)c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1 |r,c:24|
COc1cc2nc(C)oc2c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1O |r,c:25|
CC(C)CC=Nc1cc(O)c(O)c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1O |r,w:5.5,c:26|
c1cc(cc(c1)C(F)(F)F)CC(=O)Nc2cc(ccc2F)Oc3ccc4c(c3C#N)sc(n4)NC(=O)C5CC5
COc1cc2ncn(-c3cc(OCc4ccccc4S(C)(=O)=O)c(s3)C#N)c2cc1OC
COc1ccc(cc1)-c1nc2ncc(-c3nc(cs3)C(=O)NCC(C)C)c(NCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(=O)NCC(C)(C)C
COc1ccc(cc1)-c1nc2ncc(-c3csc(c3)C(O)=O)c(OCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(C(N)=S)c(NCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(-c3nc(cs3)C(O)=O)c(NCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(-c3nc(cs3)C(N)=O)c(NCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(Br)c(OCCCNC(=O)C3CCCC3)c2[nH]1
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(C)=O
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(=O)NCC(C)C
CCC(C)CNC(=O)c1cc(cs1)-c1cnc2nc([nH]c2c1)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(N)=O
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(=O)NCC(C)(C)CO
COCCNC(=O)c1cc(cs1)-c1cnc2nc([nH]c2c1)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nc2ncc(cc2[nH]1)-c1csc(c1)C(=O)NCCC(C)C
OC(C(O)C(O)=O)C(O)=O.CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(\C=C\c2ccccc2)n1
COc1ccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccnc(F)c4)n3)c(C)c2)cc1
CC(C)(C)CNC(=O)CC1CNC(=O)c2cc(cn12)-c1ccsc1
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|
O=C(NCc1ccccc1)Nc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)ccc23)cc1
CN1CCN(CCCOc2ccc3c(Nc4ccc(NC(=O)NCc5ccccc5)cc4)ncnc3c2)CC1
O=C(NCc1ccccc1)Nc1ccc(Nc2ncnc3cc(OCCCN4CCCCC4)ccc23)cc1
CC1CCCCN1CCCOc1ccc2c(Nc3ccc(NC(=O)NCc4ccccc4)cc3)ncnc2c1
CC1CCN(CCCOc2ccc3c(Nc4ccc(NC(=O)NCc5ccccc5)cc4)ncnc3c2)CC1
O=C(NCc1ccccc1)Nc1ccc(NC2=NC=NC3C=C(OCCCN4CCCC4)C=CC23)cc1 |c:19,34,t:17,22|
CCN(CC)CCCOC1=CC2N=CN=C(Nc3ccc(NC(=O)NCc4ccccc4)cc3)C2C=C1 |c:12,38,t:9,14|
CCN(CCO)CCCOC1=CC2N=CN=C(Nc3ccc(NC(=O)NCc4ccccc4)cc3)C2C=C1 |c:13,39,t:10,15|
OCCN1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NCc5ccccc5)cc4)C3C=C2)CC1 |c:14,40,t:11,16|
OCC1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NCc5ccccc5)cc4)C3C=C2)CC1 |c:13,39,t:10,15|
O=C(NC1CCCCC1)Nc1ccc(NC2=NC=NC3C=C(OCCCN4CCOCC4)C=CC23)cc1 |c:18,34,t:16,21|
CN1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NC5CCCCC5)cc4)C3C=C2)CC1 |c:12,37,t:9,14|
O=C(NC1CCCCC1)Nc1ccc(NC2=NC=NC3C=C(OCCCN4CCCCC4)C=CC23)cc1 |c:18,34,t:16,21|
CC1CCCCN1CCCOC1=CC2N=CN=C(Nc3ccc(NC(=O)NC4CCCCC4)cc3)C2C=C1 |c:15,40,t:12,17|
CC1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NC5CCCCC5)cc4)C3C=C2)CC1 |c:12,37,t:9,14|
O=C(NC1CCCCC1)Nc1ccc(NC2=NC=NC3C=C(OCCCN4CCCC4)C=CC23)cc1 |c:18,33,t:16,21|
CCN(CC)CCCOC1=CC2N=CN=C(Nc3ccc(NC(=O)NC4CCCCC4)cc3)C2C=C1 |c:12,37,t:9,14|
CCN(CCO)CCCOC1=CC2N=CN=C(Nc3ccc(NC(=O)NC4CCCCC4)cc3)C2C=C1 |c:13,38,t:10,15|
OCCN1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NC5CCCCC5)cc4)C3C=C2)CC1 |c:14,39,t:11,16|
OCC1CCN(CCCOC2=CC3N=CN=C(Nc4ccc(NC(=O)NC5CCCCC5)cc4)C3C=C2)CC1 |c:13,38,t:10,15|
COC1=CC2C(C=C1OCCCN1CCOCC1)N=CN=C2Nc1ccc(NC(=O)c2ccccc2)cc1 |c:6,20,22,t:2|
COC1CCN(CC1)c1nccc(Nc2cc(NC(=O)c3c(Cl)cccc3Cl)ccn2)n1
COC1CCN(CC1)c1nccc(Nc2cc3[nH]c(nc3cn2)-c2cn[nH]c2)n1
COC1CCN(CC1)c1nccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)n1
COC1CCN(CC1)c1nccc(Nc2cc3n(C(C)C)c(cc3cn2)-c2cn[nH]c2)n1
COC1CCN(CC1)c1nccc(Nc2cc3n(ccc3cn2)C(C)C)n1
COC1CCN(CC1)c2nccc(n2)Nc3cc4c(ccn4C5CCCC5)cn3
COC1CCN(CC1)c1nccc(Nc2cc3n(cnc3cn2)C(C)C)n1
COC1CCN(CC1)c1nccc(Nc2cc3n(nc(N)c3cn2)C(C)C)n1
COC1CCN(CC1)c1nccc(Nc2cc3c(n[nH]c3cn2)C(C)C)n1
ClCCC(=O)N1CCN(CC1)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
C=CC(=O)N1CCN(CC1)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
Oc1ccc(\C=C2\Oc3ccccc3C2=O)cc1O
O=C1Nc2ccccc2\C1=C/c1ccc2c(\C=C\c3ccncc3)n[nH]c2c1
c1cc2c(c(c1)F)c3nc(nn3c(n2)Cc4ccc5c(c4)OCO5)N
Nc1nc2c3ccc(N)cc3nc(Cc3ccc4OCOc4c3)n2n1
OCCCNc1ccc2c3ncnn3c(nc2c1)-c1ccc2OCOc2c1
c1cc2c(cc1Cc3nc4cc(ccc4c5n3nc(n5)N)NCCO)OCO2
CN1CCN(CC1)c1cc(F)c2c3nc(N)nn3c(Cc3ccc4OCOc4c3)nc2c1
CCNC(=O)Nc1ccnc2cc(cnc12)-c1ccc(OC)c(OC)c1
COc1ccc(cc1OC)-c1cnc2c(NC(=O)NC(C)(C)C)ccnc2c1
COc1cc(ccc1O)-c1cnc2c(NC(=O)NC(C)(C)C)ccnc2c1
Cn1cc(cn1)-c1cnc2c(NC(=O)NC(C)(C)C)ccnc2c1
Cn1cc(cn1)-c1cnc2c(NC(=O)Nc3ccccc3)ccnc2c1
Cn1cc(cn1)-c1cnc2c(NC(=O)NCc3ccccc3)ccnc2c1
Cn1cc(cn1)-c1cnc2c(NC(=O)NCCc3ccccc3)ccnc2c1
Cn1cc(cn1)-c1cnc2ccc(NC(=O)NCCc3ccccc3)nc2c1
Cn1cc(cn1)-c1cnc2ccc(NC(=O)NCc3ccccc3)nc2c1
Cn1cc(cn1)-c1cnc2ccc(NC(=O)Nc3ccccc3)nc2c1
Cn1cc(cn1)-c1cnc2ccc(NC(=O)NC(C)(C)C)nc2c1
COc1cc(ccc1O)-c1cnc2ccc(NC(=O)NC(C)(C)C)nc2c1
COc1ccc(cc1OC)-c1cnc2ccc(NC(=O)NC(C)(C)C)nc2c1
CCNC(=O)Nc1ccc2ncc(cc2n1)-c1ccc(OC)c(OC)c1
CCNC(=O)Nc1ccc2ncc(cc2n1)-c1ccc(OC)cc1
Fc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(O)=O)c4C)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)NCCN5CCCC5)c4C)C(=O)Nc3c2)cc1
Fc1ccc(NC(=O)C2(CC2)C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)C2(CC2)C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
Fc1ccc(cc1)-n1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
COc1ccc(cc1)-n1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
O=C(Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1)c1cccn(-c2ccccc2)c1=O
Cc1ccc(cc1)-n1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Clc1cccc(c1)-n1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Cn1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
OCCn1cccc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Cc1[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4cccn(-c5ccc(F)cc5)c4=O)ccc23)c(C)c1C(O)=O
Cc1[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4cccn(C)c4=O)ccc23)c(C)c1C(O)=O
Fc1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
COc1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
O=C(Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1)c1c[nH]cc(-c2ccccc2)c1=O
Cc1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Clc1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
FC(F)(F)c1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Clc1cccc(c1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Fc1ccccc1-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
Cc1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1=O
COc1ccc(cc1)-c1c[nH]cc(C(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(O)=O)c4C)C(=O)Nc3c2)c1=O
CN1CCN(CC1)C(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4c[nH]cc(-c5ccc(F)cc5)c4=O)ccc23)c1C
CN1CCN(CC1)C(=O)Cc1c(C)[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4c[nH]cc(-c5ccc(F)cc5)c4=O)ccc23)c1C
Cc1[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4c[nH]cc(-c5ccc(F)cc5)c4=O)ccc23)c(C)c1C(=O)N1CCOCC1
Cc1[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)c4c[nH]cc(-c5ccc(F)cc5)c4=O)ccc23)c(C)c1CC(=O)N1CCOCC1
COc1cc(OC)cc(c1)-c1cn(nn1)-c1ccc(O)c(c1)C(=O)Nc1cccc(Cl)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(nn2)-c2cc(OC)cc(OC)c2)c1
Oc1ccc(cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1cc(nn1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
COc1cc(OC)c(cc1Cl)-c1cn(nn1)-c1ccc(O)c(c1)C(=O)Nc1cccc(c1)C(F)(F)F
CC(=O)Nc1cccc(c1)-c1cn(nn1)-c1ccc(O)c(c1)C(=O)Nc1cccc(c1)C(F)(F)F
COC(=O)c1cccc(c1)-c1cn(nn1)-c1ccc(O)c(c1)C(=O)Nc1cccc(c1)C(F)(F)F
CCc1cccc(CC)c1NC(=O)Nc1ccc2[nH]nc(-c3cccc(c3)S(N)(=O)=O)c2c1
NS(=O)(=O)c1cccc(c1)-c1n[nH]c2ccc(NC(=O)C(N3CCCC3)c3ccsc3)cc12
CCc1ccccc1C(N(C)C)C(=O)Nc1ccc2[nH]nc(-c3cccc(c3)S(N)(=O)=O)c2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C/c3cccs3)C(=O)Nc2c1
COc1ccc(C(=O)NC(=O)Nc2cc3NC(=O)\C(=C/c4[nH]c(C)c(CCC(O)=O)c4C)c3cc2F)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2cc3NC(=O)\C(=C/c4[nH]c(C)c(C(O)=O)c4C)c3cc2F)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(CCC(O)=O)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(O)=O)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(cc1)C(=O)NC(=O)Nc1cc2NC(=O)\C(=C/c3[nH]c(C)c(CCC(O)=O)c3C)c2cc1F
COc1ccc(cc1)C(=O)NC(=O)Nc1cc2NC(=O)\C(=C/c3[nH]c(C)c(C(O)=O)c3C)c2cc1F
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3[nH]c(C)c(CC(O)=O)c3C)C(=O)Nc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc([nH]3)C(O)=O)C(=O)Nc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3[nH]c(C)c(c3C)-c3ccccc3)C(=O)Nc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3[nH]c(C)cc3C)C(=O)Nc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3[nH]c(C)c(C(O)=O)c3C)C(=O)Nc2c1
CN(C)c1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
COc1cc(OC)cc(c1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
Cc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
FC(F)(F)c1cc(ccc1Cl)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
FC(F)(F)c1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
Fc1ccccc1C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
Clc1ccc(cc1Cl)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
Clc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
O=C(NC(=O)c1ccccc1)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
CN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1
COc1ccc(cc1)C(=O)NC(=O)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
CCOC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)NC(=O)c4ccc(OC)cc4F)ccc23)c1C
CCOC(=O)CCc1c(C)[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)NC(=O)c4ccc(OC)cc4F)ccc23)c1C
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)N5CCN(C)CC5)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(CCC(=O)N5CCN(C)CC5)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)N5CCOCC5)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(CCC(=O)N5CCOCC5)c4C)C(=O)Nc3c2)c(F)c1
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)NCCN(C)C)c4C)C(=O)Nc3c2)c(F)c1
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3cc(NC(=O)NC(=O)c4ccc(OC)cc4F)ccc23)c1C
COc1ccc(C(=O)NC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)NCCN5CCCC5)c4C)C(=O)Nc3c2)c(F)c1
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5c(F)cccc5[nH]4)o3)C3=C(CNCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cccc(Cl)c5[nH]4)o3)C3=C(CNCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2[C@H](c3ccc(Sc4nc5c(F)cccc5[nH]4)o3)C3=C(CN(CC3=O)C(=O)CN)Nc12
CCOC(=O)c1[nH]cc2[C@H](c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CN(CC3=O)C(=O)CN)Nc12
CCOC(=O)c1[nH]cc2C(c3cc(Sc4nc5ccccc5[nH]4)cs3)C3=C(CCCC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3cnc(Sc4nc5ccccc5[nH]4)s3)C3=C(CCCC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)s3)C3=C(CCCC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CN(Cc4ccccc4)CC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CN(CC3=O)C(=O)OC(C)(C)C)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CC(C)(C)CC3=O)Nc12 |t:28|
CCOC(=O)c1c2c(c[nH]1)[C@@H](C3=C(N2)CCCC3=O)c4cccc(c4)Oc5[nH]c6ccccc6n5
CCOC(=O)c1[nH]cc2C(C3=C(CCCC3=O)Nc12)c1ccnc(Sc2nc3ccccc3[nH]2)c1 |t:10|
CCOC(=O)c1[nH]cc2C(C3=C(CCCC3=O)Nc12)c1cccc(Sc2nc3ccccc3[nH]2)n1 |t:10|
CCOC(=O)c1[nH]cc2C(C3=C(CCCC3=O)Nc12)c1cccc(Sc2nc3ccccc3[nH]2)c1 |t:10|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CN(CC)CC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5c(N)cccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5c(O)cccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cccnc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:28|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cc(Cl)ccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cccc(Cl)c5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5c(F)c(F)c(F)cc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:31|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccc(F)c(F)c5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:30|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cc(F)c(F)cc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:30|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5c(F)cc(F)cc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:30|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cccc(F)c5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5cc(F)ccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:29|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CNCC3=O)Nc12
OC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:26|
COC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:27|
CCOC(=O)c1[nH]cc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:28|
O=C1CCCC2=C1C(c1ccc(Sc3nc4ccccc4[nH]3)o1)c1c[nH]cc1N2 |c:5|
COC(=O)c1csc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:27|
Nc1nc(O)c2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc2n1 |t:25|
NC(=O)c1[nH]nc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:26|
CCOC(=O)c1[nH]nc2C(c3ccc(Sc4nc5ccccc5[nH]4)o3)C3=C(CCCC3=O)Nc12 |t:28|
O=C1CCCC2=C1C(c1ccc(Sc3nc4ccccc4[nH]3)o1)c1n[nH]cc1N2 |c:5|
O=C1CCCC2=C1C(c1ccc(Sc3nc4ccccc4[nH]3)o1)c1cn[nH]c1N2 |c:5|
CN(C)C(=O)Oc1ccc2c(C)c(Cc3cccc(c3)N(C)S(=O)(=O)CCCNCCCCCC(=O)N3CCN(CC3)c3nc(nc(n3)-n3c(nc4ccccc34)C(F)F)N3CCOCC3)c(=O)oc2c1
CN1CCC(CC1)NC(=O)c1ccc(Nc2ncc(Br)c(NC3CCCC3)n2)cc1
COc1cc(ccc1Nc1ncc(F)c(NC2CCCC2)n1)C(=O)NC1CCN(C)CC1
COc1cccc(F)c1C1=NCc2cnc(Nc3ccc(cc3)C(O)=O)nc2-c2ccc(Cl)cc12 |t:10|
OC(=O)c1ccc(Nc2ncc3CN=C(c4ccccc4F)c4cc(Cl)ccc4-c3n2)cc1 |t:13|
Nc1ncc2CN=C(c3ccccc3F)c3cc(Cl)ccc3-c2n1 |t:6|
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc2c(cc1O)ncnc2Nc3ccc(cc3)NC(=O)c4ccccc4
COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)nc(C)nc2cc1O
COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)ncnc2cc1OCCO
COc1cc2c(cc1OCC(=O)O)ncnc2Nc3ccc(cc3)NC(=O)c4ccccc4
COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)ncnc2cc1OCC(N)=O
COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)nc(N)nc2cc1O
COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)nc(NCCc3ccccn3)nc2cc1O
COc1cc(ccc1O)C(=O)Nc1ccc(NC(=O)c2ccccn2)cc1
c1ccnc(c1)C(=O)Nc2ccc(cc2)NC(=O)c3ccc(c(c3)[N+](=O)[O-])O
COc1cc(ccc1O)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1
COc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2)c(N)cc1O
COc1cc(ccc1OCC(O)=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1
COc1cc(cc(c1)C(=O)Nc2ccc(cc2)NC(=O)c3ccccn3)C4=CNC(=O)NC4=O
O=C(Nc1ccc(NC(=O)c2ccccn2)cc1)c1cccc(c1)-c1c[nH]c(=O)[nH]c1=O
COc1ccc(cc1-c1c[nH]c(=O)[nH]c1=O)C(=O)Nc1ccc(NC(=O)c2ccccn2)cc1
COc1cc(cc(c1)C(=O)Nc1ccc(NC(=O)c2ccccn2)cc1)N1CCC(=O)NC1=O
COc1cc(cc(c1)-c1c[nH]c(=O)[nH]c1=O)C(=O)Nc1ccc(NC(=O)C2CCCCN2)cc1
CCNC(=O)Nc1ccc(NC(=O)c2cc(OC)cc(c2)-c2c[nH]c(=O)[nH]c2=O)cc1
FC(F)(F)c1ccc(NC(=O)Nc2cc3NC(=O)\C(=C/c4ccc[nH]4)c3cc2N2CCCC2)cc1
CCN(CC)c1cc2\C(=C\c3ccc[nH]3)C(=O)Nc2cc1NC(C)=O
Fc1ccc(NC(=O)Nc2cc3NC(=O)\C(=C/c4ccc5OCOc5c4)c3cc2N2CCOCC2)cc1
Fc1ccc(NC(=O)Nc2cc3NC(=O)\C(=C/c4ccc[nH]4)c3cc2N2CCOCC2)cc1
c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F
[H][C@@]1(CNC(=O)O1)[C@@H](C)Oc1nc(cc2ncsc12)-c1cnn(c1)C(F)F |r|
CN(C)CCCNC(=O)c1csc2nc(cn12)-c1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
Cc1nn(cc1CN1CC(O)C1)-c1ccnc(Nc2ccc3n(C)c(C)c(Cl)c3c2)n1
Cc1nn(cc1CN1CC(O)C1)-c1ccnc(Nc2ccc3n(C)c(C)c(C)c3c2)n1
COc1ccc(cc1OC)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1
COc1ccc(F)c(c1)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1
COc1cc(F)c(cc1OC)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
Cc1oc2c(O)c3C(=O)c4ccccc4C(=O)c3c(O)c2c1C(=O)N1CC[C@H](N)C1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)ccn3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3ccccn3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)[nH]n3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CCNc3ncnc4ccsc34)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3ncnc4ccsc34)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3nc4ccccc4o3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CCNc3ncccn3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3ncccn3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)on3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3ccccc3)nn2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(nn2)-c2ccc3OCOc3c2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(nn2)-c2ccc3nccnc3c2)c1
COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(nn2)-c2cccc(c2)[N+]([O-])=O)c1
C[C@@H](N1c2cc(ccc2C(=O)NC1(C)C)-n1c2cccnc2[nH]c1=O)c1ccccc1 |r|
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4o3)cc2)cc1
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4o3)cc2)c(Cl)c1
Clc1ccc(NC(=O)Nc2ccc(CNc3nc4ccc(OCCN5CCOCC5)cc4o3)cc2)cc1Cl
Clc1ccc(NC(=O)Nc2ccc(COc3ccc4nc(NCCN5CCOCC5)oc4c3)cc2)cc1
Clc1ccc(NC(=O)Nc2ccc(COc3ccc4nc(NCCN5CCOCC5)oc4c3)cc2)cc1Cl
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3ccc(cc3)S(=O)(=O)N3CCN(CC3)C(=O)C=C)nc12
CCc1ccc(cc1)\N=C1/S\C(=C/c2ccnc(Nc3ccc(cn3)C(O)=O)c2)C(=O)N1C
c1cc(nc(c1)Nc2nccs2)CC3(CCC(CC3)Oc4cccc(c4F)Cl)C(=O)O
OC(=O)\C=C/C(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)cc12
OC(=O)CCC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
COC(=O)CCC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
OC(=O)\C=C/C(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc12
NC(=O)CCC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
CCOC(=O)CCC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
CC#CC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
OC(=O)\C=C/C(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
COc1ccc(cc1)S(=O)(=O)Nc1ccc2[nH]nc(-c3cccc(NC(=O)\C=C/C(O)=O)c3)c2c1
Cc1ccc(cc1)S(=O)(=O)Nc1ccc2[nH]nc(-c3cccc(NC(=O)\C=C/C(O)=O)c3)c2c1
CC(C)OC(=O)CCC(=O)Nc1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3ccccc3)cc12
Cc1cc(Nc2cc(C)c(C#N)c(NCCOc3ccc(C)nc3)n2)n[nH]1
CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|
FC(F)(F)CNc1nc(Nc2ccc(N3CCOCC3)c(Cl)c2)nc2ccoc12
CCCNC(=O)c1ccc(Nc2nc(NCC(F)(F)F)c3cc[nH]c3n2)cc1
Cc1c2ccc(cc2[nH]n1)Nc3nc4ccoc4c(n3)NC5CC5
CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
FC(F)(F)CNc1nc(Nc2ccc3cn[nH]c3c2)nc2ccoc12
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1 |r|
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1 |r|
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1 |r|
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1 |r|
Cc1cccc(C)c1Nc1ncnc2ccc(NC(=O)CNC(=O)OC(C)(C)C)cc12
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1 |r|
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1 |r|
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1 |r|
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1 |r|
CC(C)(C)OC(=O)NCC(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1 |r|
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1 |r|
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1 |r|
CC(C)(C)OC(=O)NCC(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1 |r|
CC(C)(C)OC(=O)NCC(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1 |r|
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1 |r|
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2ncnc(Nc3cccc(c3)C(F)(F)F)c2c1 |r|