342 SMILES Strings for Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial

Compound Name
SMILES String
N[C@H]1Cc2cn(Cc3ccccc3)nc2N(O)C1=O |r|
Cn1nc(Cc2ccccc2)c2C[C@H](N)C(=O)N(O)c12 |r|
Cn1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1ccccc1 |r|
N[C@H]1Cc2c(cnn2Cc2ccccc2)N(O)C1=O |r|
N[C@H]1Cc2c(N(O)C1=O)c(nn2Cc1ccccc1)C(F)(F)F |r|
N[C@H]1Cc2cn(Cc3ccc(OC(F)(F)F)cc3)nc2N(O)C1=O |r|
N[C@H]1Cc2cn(nc2N(O)C1=O)-c1cccc(c1)C(F)(F)F |r|
N[C@H]1Cc2cn(Cc3cccc4ccccc34)nc2N(O)C1=O |r|
N[C@H]1Cc2cn(Cc3ccc4ccccc4c3)nc2N(O)C1=O |r|
COc1ccccc1Cn1cc2C[C@H](N)C(=O)N(O)c2n1 |r|
COc1cccc(Cn2cc3C[C@H](N)C(=O)N(O)c3n2)c1 |r|
Cc1c2C[C@H](N)C(=O)N(O)c2nn1Cc1ccccc1 |r|
N[C@H]1Cc2nn(Cc3ccccc3)cc2N(O)C1=O |r|
N[C@H]1Cc2cn(nc2N(O)C1=O)-c1ccccc1 |r|
COc1ccc(Cn2cc3C[C@H](N)C(=O)N(O)c3n2)cc1 |r|
NC1Cc2nn(cc2N(O)C1=O)-c1ccccc1
Cc1c2N(O)C(=O)[C@@H](N)Cc2nn1-c1ccccc1 |r|
Cn1ncc2C[C@H](N)C(=O)N(O)c12 |r|
N[C@H]1Cc2cn(nc2N(O)C1=O)C1CCC1 |r|
CC(C)n1cc2C[C@H](N)C(=O)N(O)c2n1 |r|
COc1ccc(Cc2nn(C)c3N(O)C(=O)[C@@H](N)Cc23)cc1 |r|
COc1cccc(Cc2nn(C)c3N(O)C(=O)[C@@H](N)Cc23)c1 |r|
CCn1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1ccccc1 |r|
CC(C)n1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1ccccc1 |r|
Cn1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1cccc(c1)C(F)(F)F |r|
Cn1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1ccccc1C(F)(F)F |r|
Cn1nc2N(O)C(=O)[C@@H](N)Cc2c1Cc1ccc(cc1)C(F)(F)F |r|
N[C@H]1Cc2cn(nc2N(O)C1=O)-c1ccccc1C(F)(F)F |r|
N[C@H]1Cc2cn(nc2N(O)C1=O)-c1ccc(cc1)C(F)(F)F |r|
Cn1nc2N(O)C(=O)[C@H](N)Cc2c1Cc1ccccc1
N[C@H]1Cc2nn(cc2N(O)C1=O)-c1ccccc1 |r|
Cn1c(CN2CCOCC2)nc2sc(nc2c1=O)[C@H]1CCCN1C(=O)OCc1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)NCc1ccccc1 |r|
CC(C)n1c(nc2sc(nc2c1=O)[C@H]1CCCN1C(=O)NCc1ccccc1Cl)C(F)(F)F |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)NC1(CC1)c1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)N[C@@H]1CCc2ccccc12 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)CN1CCCc2ccccc12 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)NC(C)(C)c1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)N[C@H](C)c1ccccc1 |r|
Cc1noc(n1)-c1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Cc1nc2sc(nc2c(=O)n1C1CCOCC1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Cc1cccc(OC(=O)N2CCC[C@@H]2c2nc3c(nc(C4CCOCC4)n(C)c3=O)s2)c1 |r|
CC(C)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
O=C(Oc1ccccc1)N1CCC[C@@H]1c1nc2c(nc([nH]c2=O)-c2ccccc2)s1 |r|
Fc1ccc(c(F)c1)-c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Cc1ccccc1-c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
FC1(F)CCC(CC1)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
FCC1(CC1)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
C[C@@H](N(C)C(=O)Oc1ccccc1)c1nc2c(nc([nH]c2=O)C2(Cl)CC2)s1 |r|
Cc1cccc(OC(=O)N2CCC[C@@H]2c2nc3c(nc([nH]c3=O)C3(CC3)C#N)s2)c1 |r|
COCC1(CC1)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
FC(F)(F)C1(CC1)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Cc1ccccc1 |r|
Cc1cccc(CC(=O)N2CCC[C@@H]2c2nc3c(nc([nH]c3=O)C3(CC3)C(F)(F)F)s2)c1 |r|
CC1(CC1)Oc1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
FC(F)(F)COc1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CN(C)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
O=C(Oc1ccccc1)N1CCC[C@@H]1c1nc2c(nc([nH]c2=O)N2CCCCC2)s1 |r|
CCc1nc2sc(nc2c(=O)n1Cc1ccc(OC)cc1OC)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CCc1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CC1(COC1)c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Cc1noc(n1)-c1nc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CC(C)(F)c1nc2sc(nc2c(=O)[nH]1)N1CCCN1C(=O)Oc1ccccc1
Cc1cccc(OC(=O)N2CCCN2c2nc3c(nc([nH]c3=O)C(C)(C)F)s2)c1
CC(C)(F)c1nc2sc(nc2c(=O)[nH]1)N1CCCN1C(=O)Cc1ccccc1
Cc1cccc(CC(=O)N2CCCN2c2nc3c(nc([nH]c3=O)C(C)(C)F)s2)c1
CC(C)c1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Fc1ccccc1-c1cc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
FC(F)(F)c1cc2sc(nc2c(=O)[nH]1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)Oc1ccc(F)cc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)Cc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)Cc1ccc(F)cc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)OCc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)COc1ccccc1 |r|
CCc1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CCc1c(C)nc2sc(nn2c1=O)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
O=C(Oc1ccccc1)N1CCC[C@@H]1c1nn2c(nc3CCCCc3c2=O)s1 |r|
CC(C)c1nc2sc(nn2c(=O)c1Cl)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
Fc1ccc2nc3sc(nn3c(=O)c2c1)[C@H]1CCCN1C(=O)Oc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)NCc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)NCc1ccccc1Cl |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)Nc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)CN1CCCc2ccccc12 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)NC1(CC1)c1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)N[C@@H]1CCc2ccccc12 |r|
CC(C)c1cc(=O)n2nc(sc2n1)[C@H]1CCCN1C(=O)N1CCc2ccccc12 |r|
C[C@@H](NC(=O)N1CCC[C@@H]1c1nn2c(nc(C)c(C)c2=O)s1)c1ccccc1 |r|
Cc1nc2sc(nn2c(=O)c1C)[C@H]1CCCN1C(=O)NC(C)(C)c1ccccc1 |r|
Cc1nc2sc(nn2c(=O)c1C)[C@H]1CCCN1C(=O)Nc1csc2ncccc12 |r|
CCCc1cc(=O)n2nc(sc2n1)N1CCCN1C(=O)Oc1ccccc1
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1cccc(F)c1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
COCCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)F |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1ccccn1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1c(F)cc(F)cc1F |r,wD:15.18,(5.33,-.08,;4,-.85,;4,-2.39,;2.66,-3.16,;1.33,-2.39,;-.14,-2.87,;-1.04,-1.62,;-.14,-.37,;1.33,-.85,;2.66,-.08,;2.66,1.46,;-2.58,-1.62,;-3.49,-2.87,;-4.95,-2.39,;-4.95,-.85,;-3.49,-.37,;-3.09,1.11,;-1.6,1.51,;-4.18,2.2,;-5.66,1.8,;-6.75,2.89,;-6.36,4.38,;-7.44,5.47,;-8.93,5.07,;-9.33,3.58,;-8.24,2.49,;5.33,-3.16,;5.33,-4.7,;4,-5.47,;6.66,-5.47,;8,-4.7,;9.33,-5.47,;8,-3.16,;6.66,-2.39,;7.43,-1.06,)|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1c(F)cccc1F |r,wD:15.18,(6,-.08,;4.66,-.85,;4.66,-2.39,;3.33,-3.16,;1.99,-2.39,;.53,-2.87,;-.37,-1.62,;.53,-.37,;1.99,-.85,;3.33,-.08,;3.33,1.46,;-1.91,-1.62,;-2.82,-2.87,;-4.28,-2.39,;-4.28,-.85,;-2.82,-.37,;-2.42,1.11,;-.93,1.51,;-3.51,2.2,;-5,1.8,;-6.09,2.89,;-5.69,4.38,;-6.78,5.47,;-8.26,5.07,;-8.66,3.58,;-7.57,2.49,;6,-3.16,;6,-4.7,;4.66,-5.47,;7.33,-5.47,;8.66,-4.7,;8.66,-3.16,;7.33,-2.39,;8.1,-1.06,)|
Cc1noc(n1)-c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1noc(n1)-c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccc(F)cc1 |r|
Cc1noc(n1)-c1nc2sc(nc2c(=O)n1CC(F)F)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC1(Cn2c(nc3sc(nc3c2=O)N2CCC[C@@H]2C(=O)NCc2ccccc2)C(F)(F)F)COC1 |r|
Cc1ccccc1CNC(=O)[C@H]1CCCN1c1nc2c(nc(C)n(C)c2=O)s1 |r|
CCc1nc2sc(nc2c(=O)n1C)N1CC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1CC)N1CCCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2c(ncn(C3CCCC3)c2=O)s1 |r|
FC(F)(F)c1nc2sc(nc2c(=O)n1C1CCOCC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)c1nc2sc(nc2c(=O)n1C1COC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)c1nc2sc(nc2c(=O)n1N1CCCC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)c1nc2sc(nc2c(=O)n1N1CCOCC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)c1nc2sc(nc2c(=O)n1CC1CCOCC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1nc2sc(nc2c(=O)n1C1CC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN1C(=O)c2c(sc(n2)N3CCC[C@@H]3C(=O)NCc4ccccc4)N=C1C5CCOCC5
CN1CCC(CC1)n1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
C[C@@H](NC(=O)[C@H]1CCCN1c1nc2c(nc(n(C)c2=O)C(C)(F)F)s1)c1ccccc1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1(F)CC1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)c1ccccn1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)F |r|
CN(C)CCCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1ncccc1F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)N[C@H](C1CC1)c1ccccc1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)N[C@H](COC)c1ccccc1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)N[C@@H](c1ccccc1)C(F)(F)F)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccc2OCOc2c1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1cccs1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1cc(C)on1)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1cc(C)nn1C)C(F)F |r|
CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1nccs1)C(F)F |r|
COC1CN(Cc2nc3sc(nc3c(=O)n2C)N2CCC[C@@H]2C(=O)NCc2ccccc2)C1 |r|
Cn1c(CN2CCOCC2)nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN(C)Cc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(CN2Cc3ccccc3C2)nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN(Cc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1)CC(F)(F)F |r|
CN(C)c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)N1CCCCC1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)N1CCOCC1 |r|
CC(C)Nc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1ccccc1F |r|
CNCCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
CN1CCC(Cn2c(nc3sc(nc3c2=O)N2CCC[C@@H]2C(=O)NCc2ccccc2)C(F)(F)F)CC1 |r|
CN(C)CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
CN(CCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F)CC(F)(F)F |r|
C[C@@H](N(C)C)c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
OCCn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
CN(C)CCOc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(=O)c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COc1ccc(Cn2c(nc3sc(nc3c2=O)N2CCC[C@@H]2C(=O)NCc2ccccc2)C(C)(C)F)c(OC)c1 |r|
CC(C)(F)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1nc2sc(nc2c(=O)[nH]1)N(C)[C@H](C)C(=O)NCc1ccccc1 |r|
Fc1ccccc1-c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
C[C@@H](NC(=O)[C@H]1CCCN1c1nc2c(nc([nH]c2=O)-c2ccc(F)cc2F)s1)c1ccccc1 |r|
Cc1ccc(s1)-c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1cc(F)c(s1)-c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(c1ccccc1)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(CCS(=O)(=O)c1ccccc1)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
C[C@@H](N(C)c1nc2c(nc([nH]c2=O)-c2ccccc2F)s1)C(=O)NCc1ccccc1 |r|
FC(F)(F)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)[C@@H]1CCCN1c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)COc1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1nc2sc(nc2c(=O)n1C1CCOCC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(nc2sc(nc2c1=O)N1CC(F)(F)C[C@@H]1C(=O)NCc1ccccc1)C1CC1 |r|
Cn1c(nc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1(CC1)C#N |r|
CCc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)COc1ccccc1 |r|
COC1CN(C1)c1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)COc1ccccc1 |r|
CCc1nc2sc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)CNc1ccccc1 |r|
Fc1cccc(F)c1-c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1noc(n1)-c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN1CCn2c(C1)nc1sc(nc1c2=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)CN1CCn2c(C1)nc1sc(nc1c2=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
C[C@@H]1CN(C)Cc2nc3sc(nc3c(=O)n12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN1CCn2c1nc1sc(nc1c2=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1ccn2c1nc1sc(nc1c2=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC1(F)CCCn2c1nc1sc(nc1c2=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)(O)c1nc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(nc2sc(nc2c1=O)N1CC[C@@H](N)[C@@H]1C(=O)NCc1ccccc1)-c1ccccc1 |r|
CCc1nn(CC)c(=O)c2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1nn(C2CCOCC2)c(=O)c2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCn1nc(C2CC2)c2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1nn(C2CCCCC2)c(=O)c2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
FC(F)(F)c1c[nH]c(=O)c2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Clc1c([nH]c(=O)c2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1CC1 |r|
Fc1ccccc1-c1[nH]c(=O)c2nc(sc2c1Cl)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)(F)c1[nH]c(=O)c2nc(sc2c1Cl)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCOC1(CC1)c1cc2sc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(cc2sc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
CCCc1cc(=O)n2nc(sc2n1)N1CCCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1cc(=O)n2nc(sc2n1)N1CCC[C@@H]1C(=O)NC(C)(C)c1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nn2c(nc(cc2=O)-c2ccccc2)s1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nn2c(nc3CCCCc3c2=O)s1 |r|
FC(F)(F)c1cc(=O)n2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1cc(=O)n2nc(sc2n1)N1CCOC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1c(C)nc2sc(nn2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1nc2sc(nn2c(=O)c1-c1ccccc1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CC(F)(F)C[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1cc(=O)n2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccccn1 |r|
O=C(NC1(CC1)c1ccccc1)[C@H]1CCCN1c1nn2c(nc3ccccc3c2=O)s1 |r|
Cc1cc2c(nc3sc(nn3c2=O)N2CCC[C@@H]2C(=O)NCc2ccccc2)s1 |r|
Cc1cc(=O)n2nc(sc2n1)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1cc(C)ccn1 |r|
Cc1cc(=O)n2nc(sc2n1)N1CCC[C@@H]1C(=O)N[C@@H]1CCCc2ccccc12 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1ccccc1Cl |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1ncccn1 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1cnc(C)cn1 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1nnc2ccccn12 |r|
CCc1nc2sc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1ccc(Cl)cc1Cl |r|
CC1=C(C(=O)C2N=C(SC2=N1)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1=CCOCC1 |r,c:6,10,t:1,30|
CCc1cc2sc(nn2c(=O)c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1c(Cl)c2sc(nn2c(=O)c1Cl)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1nc2ccc(nc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1nc2ccc(nc2c(=O)n1CC(F)(F)F)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cn1c(nc2ccc(nc2c1=O)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
ClC1(CC1)c1nc2ccc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1nc2ccc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Fc1ccccc1-c1nc2ccc(nc2c(=O)[nH]1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1ccc2nc(cc(=O)n2n1)-c1ccccc1 |r|
CCCc1cc(=O)n2nc(ccc2n1)N1CCC[C@@H]1C(=O)NC1(CC1)c1ccccc1 |r|
CC(C)c1cc(=O)n2nc(ccc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1nc2ccc(nn2c(=O)c1F)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2c(nc([nH]c2=O)N2CCCCC2)s1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(N3CCOCC3)c2s1 |r|
CC1(C)CN(CCO1)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CON(C)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN(C)c1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
COCc1nc(N(C)C)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCCc1nc(N(C)C)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN(C)c1nc(C)nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCOc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCCOc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(C3CC3)c2s1 |r|
CCc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCCc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)(C)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC1(CC1)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCCc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(-c3ccccn3)c2s1 |r|
C[C@@H](N(C)c1nc2ncnc(C3CC3)c2s1)C(=O)NCc1ccccc1 |r|
COCCN([C@H](C)C(=O)NCc1ccccc1)c1nc2ncnc(C3CC3)c2s1 |r|
C[C@@H](N(Cc1ccccn1)c1nc2ncnc(C3CC3)c2s1)C(=O)NCc1ccccc1 |r|
CCc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1CC1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2nc(CC3CCOCC3)nc(C3CC3)c2s1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2nc(nc(C3CC3)c2s1)-c1ccncc1 |r|
FC(F)c1nc(C2CCOCC2)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1nc(c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
CN(C)Cc1nc(C2CC2)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(Oc3ccccc3)c2s1 |r|
CCNc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C(F)(F)F |r|
FC(F)(F)COc1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCOc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1CCOCC1 |r|
CC(C)(C#N)c1ncnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1ccc(F)cc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2nc(COC3CCOCC3)nc(C3CC3)c2s1 |r|
Cc1nc(OC2CCOCC2)nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCOc1nc(C)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(OC3CCC3)c2s1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncnc(OC3CCOCC3)c2s1 |r|
CN(c1nc2ncnc(C3CC3)c2s1)C(C)(C)C(=O)NCc1ccccc1
CN([C@H](C1CC1)C(=O)NCc1ccccc1)c1nc2ncnc(C3CC3)c2s1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2nc(CN3CCOCC3)nc(C3CC3)c2s1 |r|
O=C(NCc1ccccc1)[C@H]1CSCN1c1nc2ncnc(C3CC3)c2s1 |r|
CCc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)-n1nccn1 |r|
CCc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)-n1nc(C)cc1C |r|
CN(C)c1nc(C2CC2)c2sc(nc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1nc2nc(sc2c(=O)n1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CC(C)(C#N)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(cc2s1)C1(CCC1)C#N |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(cc2s1)C1(CCOCC1)C#N |r|
COCC1(CC1)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1cc2sc(nc2nc1C)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1cc2sc(nc2nc1C)N1CCC[C@@H]1C(=O)NC1(CC1)c1ccccc1 |r|
FC(F)(F)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
OC1(CCC1)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COC1(CCC1)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(cc2s1)C1CCOCC1 |r|
Cc1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Cc1cnc2nc(sc2c1C#N)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
COCc1ccnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
C[C@@H](NC(=O)[C@H]1CCCN1c1nc2ncc(cc2s1)-c1noc(C)n1)c1ccccc1 |r|
Cc1nc(no1)-c1c(C)cnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(OC3COC3)cc2s1 |r|
COCc1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(C#N)c(C3CC3)c2s1 |r|
Fc1ccc(CNC(=O)[C@H]2CCCN2c2nc3ncc(cc3s2)C2CC2)cc1 |r|
COCc1c(F)cnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCOc1c(COC)cnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1c(cnc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)-c1cnn(C)c1 |r|
Cc1nc(co1)C(C)(C)c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(CN3CCCCC3)c(C3CC3)c2s1
CN(C)Cc1cnc2nc(sc2c1C1CC1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
Clc1ccccc1CNC(=O)[C@H]1CCCN1c1nc2ncc(cc2s1)C#N |r|
Cc1nc(no1)-c1cnc2nc(sc2c1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1cnc2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CCc1cnc2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccc(F)cc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(nc2s1)-c1ccccc1 |r|
CCOc1cnc2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
CN(C)c1cnc2nc(sc2n1)N1CCC[C@@H]1C(=O)NCc1ccccc1 |r|
O=C(NCc1ccccc1)[C@H]1CCCN1c1nc2ncc(nc2s1)C1CC1
Cc1cnc2nc(sc2c1)[C@H]1CCCN1C(=O)Cc1ccccc1
Cc1cnc2nc(sc2c1)[C@@H]1CCCN1C(=O)Oc1ccccc1
Cc1cnc2nc(sc2c1)[C@H]1CCCN1C(=O)NC1(CC1)c1ccccc1
CCS(=O)(=O)c1ccc(cc1)C(=O)C[C@H](N)C(O)=O |r|
O=C1NC(=O)\C(S1)=C\c1cccc(c1)-c1ccc2CCN3c2c1CCC3=O
C[C@H]1COc2c(N3CCN(N)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O |r|
N[C@H]1Cc2ccccc2N(O)C1=O |r|
N[C@H]1Cc2c(cccc2C(F)(F)F)N(O)C1=O |r|
N[C@H]1Cc2cc(ccc2N(O)C1=O)C(F)(F)F |r|
N[C@H]1Cc2c(F)cccc2N(O)C1=O |r|
N[C@H]1Cc2c(Cl)cccc2N(O)C1=O |r|
Cc1cccc2N(O)C(=O)[C@@H](N)Cc12 |r|
COc1cccc2N(O)C(=O)[C@@H](N)Cc12 |r|
N[C@@H]1Cc2ccccc2N(O)C1=O |r|
CON1C(=O)[C@@H](N)Cc2ccccc12 |r|
CC1(N)Cc2ccccc2N(O)C1=O
C[C@@H]1[C@H](N)C(=O)N(O)c2ccccc12 |r|
N[C@H]1Cc2cccc(F)c2N(O)C1=O |r|
COc1cccc2C[C@H](N)C(=O)N(O)c12 |r|
N[C@H]1Cc2cccc(Cl)c2N(O)C1=O |r|
Cc1cccc2C[C@H](N)C(=O)N(O)c12 |r|
N[C@H]1Cc2cccc(c2N(O)C1=O)C(F)(F)F |r|
N[C@H]1Cc2ccc(Cl)cc2N(O)C1=O |r|
Cc1ccc2C[C@H](N)C(=O)N(O)c2c1 |r|
COc1ccc2C[C@H](N)C(=O)N(O)c2c1 |r|
N[C@H]1Cc2cc(Cl)ccc2N(O)C1=O |r|
Cc1ccc2N(O)C(=O)[C@@H](N)Cc2c1 |r|
N[C@H]1Cc2ccccc2NC1=O |r|
C[C@@H]1COc2c(N3CCN(N)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O |r|
COc1cc2N(O)C(=O)[C@@H](N)Cc2cc1Oc1ccccc1 |r|
N[C@H]1Cc2cc(Oc3ccccc3)ccc2N(O)C1=O |r|
COc1cc2N(O)C(=O)[C@@H](N)Cc2cc1Cc1ccccc1 |r|
CCc1cccc(NC(=O)N2CCCC3(CCC(=O)N(CCC(C)C)C3)C2)c1
CC(C)CCN1CC2(CCCN(C2)C(=O)Nc2ccc(C)c(Cl)c2)CCC1=O
Cc1cc(C)cc(NC(=O)N2CCCC3(CCC(=O)N(C3)C3CC3)C2)c1
Fc1ccc(NC(=O)N2CCCC3(CCC(=O)N(CC4CC4)C3)C2)cc1Cl
COc1ccc(NC(=O)N2CCCC3(CCC(=O)N(C3)C3CC3)C2)cc1
Fc1cc(F)cc(c1)S(=O)(=O)Nc1nnc(s1)C1(CC1)c1ccccc1
CC(C)C(Cc1nnc(NS(=O)(=O)c2cc(F)cc(F)c2)s1)c1cccc(F)c1
O=C1NC(=O)\C(S1)=C\c1cccc(c1)C1=C2CCC(=O)N3CCC(C=C1)C23 |c:16,26|
OC(=O)C(Cc1ccccc1)N1C(=O)c2cc(Cl)c(Cl)cc2C1=O