452 SMILES Strings for Ubiquitin carboxyl-terminal hydrolase 30 [57-517]

Compound Name
SMILES String
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2nc(sc2c1)-n1cccc1 |r,THB:10:9:7.6:3.4|
CC(C)(C)OC(=O)N1CCc2ccc(cc2C1)C(=O)NC1CC2CCC1N2C#N |THB:27:26:20.21:23.24|
CC(C)(C)OC(=O)N1CCc2cc(ccc2C1)C(=O)NC1CC2CCC1N2C#N |THB:27:26:20.21:23.24|
Fc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(F)cc1Nc1nccc(n1)C1CC1 |r,THB:14:13:8.7:11.10|
Fc1c(Nc2nccc(n2)C2CC2)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1F |r,THB:26:25:20.19:23.22|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2c(n[nH]c2c1)-c1ccccc1 |r,THB:10:9:4.3:7.6|
Cc1cc(ccc1NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:19.18:22.21|
CC(C)(C)C(=O)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:19.18:22.21|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cc1)-c1cscn1 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(NC(=O)c2ccccc2)cc1 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(NC(=O)c2ccccn2)cc1 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cc1)C#Cc1ccccc1 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(nc1)-n1cnc2ccccc12 |r,THB:10:9:4.3:7.6|
Clc1ccc(Oc2ccc(cc2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)nc1 |r,THB:22:21:16.15:19.18|
Cc1cc(C)n(n1)-c1ccc(cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCCS1(=O)=O |r,THB:17:16:11.10:14.13|
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:22:21:19.18:15.16|
CC(C)CC(=O)Nc1ccc(cc1C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Cc1cnn(c1)-c1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cc1)-n1nnc2ccccc12 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1cccc(c1)-c1ccncc1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(OCC2CC2)nc1 |r,THB:10:9:7.6:3.4|
Clc1cccnc1-c1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cc1)-c1cccnc1 |r,THB:10:9:7.6:3.4|
Cc1ccn(n1)-c1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
FC(F)(F)c1cnn(c1)-c1ccc(cc1)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C#N |r,THB:25:24:22.21:18.19|
Cc1nn(-c2ccc(cc2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c2ncccc12 |r,THB:20:19:17.16:13.14|
Cc1cnn(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:20:19:17.16:13.14|
Cc1cn(cn1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(F)c1 |r,THB:20:19:17.16:13.14|
Cc1cnn(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(C)c1 |r,THB:20:19:17.16:13.14|
Cc1cnn(c1)-c1ccc(cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Fc1ccc(cc1)-c1ccc(nc1)C(=O)NC1CC2CCC1N2C#N |THB:23:22:20.19:16.17|
Clc1ccc(cc1)-c1ccc(cn1)C(=O)NC1CC2CCC1N2C#N |THB:23:22:20.19:16.17|
Clc1ccc(cc1)-c1ccc(cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Cc1cccc(Nc2ncc(cn2)C(=O)NC2CC3CCC2N3C#N)c1 |THB:23:22:20.19:16.17|
Fc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1CC1 |r,THB:20:19:17.16:13.14|
Cc1cc(cc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:26:25:23.22:19.20|
Cc1ccnc(c1)-n1ccc2cc(cnc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Cc1csc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
Cc1cccc(n1)-n1ncc2C[C@H](CCc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Cc1ccnc(n1)-c1c[nH]c2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
COc1cc2n(ccc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1nccc(C)n1 |r,THB:21:20:18.17:14.15|
Cc1cccc(n1)-c1nn(C)c2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
Cn1nc(-c2cccc(n2)C(F)(F)F)c2ccc(cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:30:29:27.26:23.24|
Cn1nc(-c2ccccc2)c2ccc(cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Fc1cccc(OCc2cccc(c2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:24:23:21.20:17.18|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(OCc2cccs2)cc1 |r,THB:10:9:7.6:3.4|
Cc1ccccc1Sc1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
CC(C)CCOc1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(Sc2ccccc2C#N)cc1 |r,THB:10:9:7.6:3.4|
Cc1nn(-c2cccc(n2)C2CC2)c2ccc(cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1CC1 |r,THB:20:19:17.16:13.14|
Cc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1CC1 |r,THB:20:19:17.16:13.14|
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c2cc(Br)ccc12 |r,THB:13:12:10.9:6.7|
Brc1ccc2C[C@H](Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:20:19:17.16:13.14|
Cc1c(sc2ccc(Br)cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:21:20:18.17:14.15|
Brc1cccc(c1)C(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)Cc1ccccc1 |r,THB:21:20:14.15:17.18|
Clc1cccc(c1)C(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)Cc1ccccc1 |r,THB:21:20:14.15:17.18|
Brc1cccc(c1)C(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:21:20:14.15:17.18|
Clc1cccc(c1)C(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:21:20:14.15:17.18|
Clc1cccc(c1)N1C[C@H](CC1=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Brc1cccc(c1)N1C[C@@H](CC1=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
Clc1cccc(c1)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)C1=O |r,THB:21:20:15.14:18.17|
Clc1cccc(c1)-c1nc(cs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:16.15:19.18|
FC(F)(F)c1cc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)ccc1Cl |r,THB:19:18:13.12:16.15|
Clc1cccc(c1)-c1cc(on1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:16.15:19.18|
FC(F)(F)c1cccc(c1)-c1csc(NC(=O)C2CC3CCC2N3C#N)n1 |THB:24:23:18.17:21.20|
Cc1ccc(F)c(c1)-c1ccc2N(CCc2c1)C(=O)C1CC2CCC1N2C#N |THB:26:25:20.19:23.22|
Cc1ccc(F)c(c1)-c1ccc2N(CCc2c1)C(=O)C1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
Cc1cc(C)nc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:27:26:24.23:20.21|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)c1cccc(n1)C1CC1 |THB:10:9:7.6:3.4|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)c1cncc(n1)C1CC1 |THB:10:9:7.6:3.4|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)c1cccc(c1)C1CC1 |THB:10:9:7.6:3.4|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)c1cc(ccn1)C1CC1 |THB:10:9:7.6:3.4|
COc1ccnc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:27:26:24.23:20.21|
FC(F)(F)c1ccnc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:29:28:26.25:22.23|
CC(C)(C)c1ccnc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:29:28:26.25:22.23|
CC(C)c1ccnc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:28:27:25.24:21.22|
CCc1ccnc(n1)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2N(CCc2c1)c1nccc(n1)C#N |r,THB:10:9:7.6:3.4|
Cc1cc(nc(n1)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:26:25:23.22:19.20|
FC(F)c1ccnc(n1)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
Cc1cc(nc(n1)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(F)(F)F |r,THB:26:25:23.22:19.20|
Cc1ccc(F)c(n1)N1CCc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:21.20|
Cc1ccnc(n1)-n1ccc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:20.19|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)c1ncccn1 |THB:10:9:7.6:3.4|
Cc1cnc(nc1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1ccc2N(CCc2c1)c1nccc(n1)C1CC1 |r,THB:9:8:6.5:3.2|
CN([C@H]1C[C@H]2CC[C@@H]1N2C#N)C(=O)c1ccc2N(CCc2c1)c1nccc(n1)C1CC1 |r,THB:9:8:6.5:3.2|
O=C(NC1CC1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:25:24:22.21:19.18|
FC(F)(F)c1ccc(NC(=O)NC2CC3CCC2N3C#N)cc1 |THB:19:18:16.15:12.13|
Cc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:17.16|
Cn1cc(cn1)-c1ccc(cc1OCC1CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:21.20|
CCCOc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:20.19|
CCOc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:19.18|
CC(C)Oc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:20.19|
COc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
Cn1cc(cn1)-c1ccc(cc1OC(F)(F)F)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:21.20:24.23|
Cn1cc(cn1)-c1ccc(cc1C(F)(F)F)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:20.19:23.22|
FC(F)(F)c1cccc(n1)-c1n[nH]c2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:23.22:26.25|
Brc1cccc(CN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)Cc2ccccc2)c1 |r,THB:19:18:15.16:12.13|
Clc1cccc(CN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)Cc2ccccc2)c1 |r,THB:19:18:15.16:12.13|
O=C(CSc1ncnc2sc3CCCCc3c12)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
CC(C)CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)Cc1cccc(Br)c1 |r,THB:16:15:13.12:9.10|
COc1ccc(CN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)Cc2cccc(Cl)c2)cc1 |r,THB:19:18:15.16:12.13|
Clc1cc(Cl)c2CCN(CC(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)Cc2c1 |r,THB:20:19:17.16:13.14|
Cc1ccnc(n1)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCc2c1)C(=O)C1CC1 |THB:10:9:7.6:3.4|
Cc1cccc(n1)-n1ncc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(Cl)cc12 |r,THB:23:22:20.19:16.17|
Cc1cccc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Cc1cccc(n1)-n1ncc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(F)cc12 |r,THB:23:22:20.19:16.17|
O=C(NC1CC2CCC1N2C#N)c1ccc2N(CCOc2c1)c1nccc(n1)C1CC1 |THB:10:9:6.7:4.3|
Clc1ccc(OCC(=O)C[C@H]2C[C@H]3CC[C@@H]2N3C#N)c2ccccc12 |r,THB:17:16:14.13:10.11|
Clc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c2ccccc12 |r,THB:17:16:14.13:10.11|
CC(C)(C)OC(=O)N1CCc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
Cc1ccnc(n1)-n1ncc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
Cc1ccnc(n1)-n1cnc2cc(ccc12)C(=O)NC1CC2CCC1N2C#N |THB:26:25:23.22:19.20|
O=C(NC1CC2CCC1N2C#N)c1ccc2n(ncc2c1)-c1cc(ccn1)C1CC1 |THB:10:9:7.6:3.4|
O=C(NC1CC2CCC1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)C1CC1 |THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)C1CC1 |r,THB:10:9:7.6:3.4|
FC(F)(F)c1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)ccc1Cl |r,THB:19:18:16.15:12.13|
CCc1cccc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:21.20:24.23|
Cc1ccnc(n1)-n1ccc2nc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:20.19:23.22|
Cc1ccnc(n1)-n1ccc2c(F)c(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:21.20:24.23|
CN(c1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1nccc(C)n1 |r,THB:18:17:12.11:15.14|
Cc1ccnc(n1)-n1ccc2c(C)c(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:21.20:24.23|
O=C(NC1CC2CCC1N2C#N)c1ccc(Nc2ncccn2)cc1 |THB:10:9:4.3:7.6|
Cc1noc(C)c1-c1ccc2cc([nH]c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:20.19:23.22|
O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C#N)c1ccc2N(CCc2c1)c1nccc(n1)C1CC1 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2N(CCc2c1)c1nccc(n1)C1CC1 |r,THB:10:9:4.3:7.6|
Cn1cc(cn1)-c1ccc(cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:16.15:19.18|
Cc1ccnc(n1)N1CCc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(Cl)cc12 |r,THB:23:22:17.16:20.19|
Clc1cc(NC(=O)C2CC2)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-n1ncc2ccccc12 |r,THB:17:16:11.10:14.13|
Clc1ccc2[nH]c3CC[C@@H](Cc3c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1ccc2OCCC(Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
Cc1cccc(n1)-c1nn(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(Cl)cc12 |r,THB:24:23:21.20:17.18|
Cc1cccc(n1)-c1nn(CC2CC2)c2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:30:29:27.26:24.23|
CC(C)Cn1nc(-c2cccc(C)n2)c2ccc(cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:30:29:27.26:23.24|
Cc1cccc(n1)-c1nn(CCCC(F)(F)F)c2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:33:32:30.29:26.27|
CCCn1nc(-c2cccc(C)n2)c2ccc(cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
FC(F)(F)COc1cccc(n1)-n1ncc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(Cl)cc12 |r,THB:28:27:25.24:21.22|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2ccncc2n1 |r,THB:20:19:17.16:13.14|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(CC#N)n1 |r,THB:20:19:17.16:13.14|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2cccnc2n1 |r,THB:20:19:17.16:13.14|
Clc1cccc(c1)-c1csc(n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1csc(n1)-c1ccsc1 |r,THB:10:9:7.6:3.4|
Clc1cccc(c1)-n1ccc(n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
Cc1cc(nn1-c1cccc(Cl)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Cc1nc(cs1)-c1cccc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
Brc1ccc2cc([nH]c(=O)c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCN(C1)c1ccccc1 |r,THB:10:9:6.7:3.4|
CC1C(CCN1c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
Fc1cc(ccc1N1CCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:22:21:18.19:15.16|
Clc1cccc(c1)N1CCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(o1)-c1ccccc1 |r,THB:10:9:6.7:3.4|
CC(C)c1cccc(c1)-c1ccc(o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:20.21:17.18|
FC(F)(F)c1cccc(c1)-c1ccc(o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:21.22:18.19|
Clc1cccc(c1)N1CCCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:19.20:16.17|
FC(F)(F)c1ccnc(n1)N1CCC(CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:22.23:19.20|
Brc1cccc(c1)N1CCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
FC(F)(F)c1ccc(cc1Cl)N1CCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:22.23:19.20|
Clc1ccc2OCC(Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:21:20:17.18:14.15|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1CC1 |r,THB:17:16:14.13:10.11|
Clc1cccc(c1)N1CCC(CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Clc1cc(Cl)cc(c1)N1CCC(CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Cc1ccnc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCN(C1)c1cncc(c1)C#N |r,THB:10:9:7.6:3.4|
COc1cc(ccn1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Cc1cccc(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
Cc1cncc(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
CC1(CCN(C1)c1cc(Cl)cc(Cl)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
FC1(CCN(C1)c1cc(Cl)cc(Cl)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cc(Cl)cc(c1)N1CC(C2CC12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cccc(c1)-c1ncc(o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCN(C1)c1cccc(CC#N)c1 |r,THB:10:9:7.6:3.4|
COc1cc(Cl)cc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cc(Cl)cc(c1)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Clc1cccc(c1)-c1cccc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Cc1cnc(cc1-c1cc(Cl)ccc1Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
Cc1cnc(cc1-c1cccc(Cl)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCN(CC1)c1cccc(n1)C1(CC1)C#N |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(nc1)-c1cccc(c1)C1(CC1)C#N |r,THB:10:9:7.6:3.4|
Fc1cc(cc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1)C1CC1 |r,THB:21:20:18.17:14.15|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cn1)-c1cccc(n1)C1(CC1)C#N |r,THB:10:9:7.6:3.4|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CC1)C#C |r,THB:17:16:14.13:10.11|
C[C@]1(CCc2ccc(cc12)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1)C#N |r,THB:24:23:21.20:17.18|
C[C@@]1(CCc2ccc(cc12)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1)C#N |r,THB:24:23:21.20:17.18|
CC(C)(C)c1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:21.20:17.18|
Clc1cc(Cl)cc(c1)N1CC[C@@H]2[C@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
Clc1cc(Cl)cc(c1)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
Clc1cc(Cl)cc(c1)N1CCC2C(C1)C2C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCCN(C1)c1cccc(n1)C1CC1 |r,THB:10:9:7.6:3.4|
Clc1cc(Cl)cc(c1)N1C[C@H]2C[C@]2(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cc(Cl)cc(c1)N1C[C@H]2C[C@@]2(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCCN(C1)c1cccc(n1)C1(CC1)C#N |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1nn(C2CCCC2)c2ccccc12 |r,THB:10:9:4.3:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCN(CC1)c1cccc(n1)C1CC1 |r,THB:10:9:4.3:7.6|
Clc1cc(Cl)cc(c1)-n1cnc(n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
CC(C)(C#N)c1cncc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:25:24:19.18:22.21|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCC[C@@H](C1)C#N |r,THB:17:16:11.10:14.13|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCC[C@H](C1)C#N |r,THB:17:16:11.10:14.13|
CC1(CCc2ccc(cc12)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1)C#N |r,THB:24:23:18.17:21.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CC2CC1CC[C@@H]2C#N |r,THB:17:16:11.10:14.13|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccn(n1)-c1cccc(c1)C#N |r,THB:10:9:4.3:7.6|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CCC1)C#N |r,THB:17:16:11.10:14.13|
Clc1cc(Cl)cc(CN2CC[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:22:21:16.15:19.18|
Clc1cc(Cl)cc(CN2CC[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:22:21:19.18:15.16|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CC[C@@H](CC#N)C1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CC[C@H](CC#N)C1 |r,THB:17:16:14.13:10.11|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1nn(-c2cccc(c2)C#N)c2ccccc12 |r,THB:10:9:7.6:3.4|
Clc1cc(Cl)cc(CN2CC[C@H](C2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:23:22:20.19:16.17|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCN(C1)c1cccc(n1)C1(CC1)C#N |r,THB:10:9:7.6:3.4|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CC2CC1CC[C@H]2C#N |r,THB:17:16:14.13:10.11|
Clc1cc(OCC2(CC2)C#N)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(cc1C1CC1)-c1cccc(n1)C1(CC1)C#N |r,THB:10:9:7.6:3.4|
Clc1c(O[C@H]2C[C@H](C2)C#N)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,wU:19.26,22.25,4.3,6.8,wD:17.18,THB:24:23:21.20:17.18,(-.8,2.08,;-.8,.54,;-2.13,-.23,;-3.46,.54,;-4.8,-.23,;-5.2,-1.71,;-6.68,-1.31,;-6.28,.17,;-8.02,-2.08,;-9.35,-2.85,;-2.13,-1.77,;-.8,-2.54,;.54,-1.77,;.54,-.23,;1.87,.54,;1.87,2.08,;3.2,-.23,;4.54,.54,;4.54,2.08,;5.87,2.85,;7.21,2.08,;7.21,.54,;5.87,-.23,;6.27,1.37,;7.81,1.37,;9.35,1.37,)|
Clc1cc(O[C@H]2C[C@H](C2)C#N)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,wU:19.26,22.25,5.4,7.9,wD:17.18,THB:24:23:21.20:17.18,(-3.2,5.32,;-3.2,3.78,;-4.53,3.01,;-4.53,1.47,;-5.86,.7,;-5.86,-.84,;-4.77,-1.92,;-5.86,-3.01,;-6.95,-1.92,;-5.86,-4.55,;-5.86,-6.09,;-3.2,.7,;-1.86,1.47,;-1.86,3.01,;-.53,3.78,;-.53,5.32,;.81,3.01,;2.14,3.78,;2.14,5.32,;3.47,6.09,;4.81,5.32,;4.81,3.78,;3.47,3.01,;3.87,4.61,;5.41,4.61,;6.95,4.61,)|
FC1(F)CC(C1)(C#N)c1ccc(cn1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:28:27:25.24:21.22|
Clc1c(cccc1-c1cccc(c1)C1(CC1)C#N)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCC[C@@H](CC#N)C1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCC[C@H](CC#N)C1 |r,THB:17:16:14.13:10.11|
Fc1cc(cc(c1)C1(CC1)C#N)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:26:25:23.22:19.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-n1ncc2CCCCc12 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)NC1C[C@@H]2CC[C@H]1N2C#N)-n1ncc2CCCc12 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)NC1C[C@@H]2CC[C@H]1N2C#N)-n1cc2CCCc2n1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)N1CCCC(CC#N)C1 |r,THB:17:16:14.13:10.11|
Clc1cc(Cl)cc(c1)N1CCCCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@H]1CCc2c(C1)c1cc(Cl)ccc1n2C |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1cc2cnn(-c3cccc(n3)C3CC3)c2cc1F |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1cc2cnn(-c3cccc(C)n3)c2cc1Cl |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1cc2cnn(-c3cccc(C)n3)c2cc1F |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1ccc2c(nn(C)c2c1)-c1cccc(C)n1 |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@@H]1CCN(C1)c1cccc(Cl)c1 |r,THB:9:8:5.6:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@H]1CCN(C1)c1cccc(Cl)c1 |r,THB:9:8:5.6:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@H]1CN(C(=O)C1)c1cccc(Cl)c1 |r,THB:9:8:5.6:2.3|
CN([C@@H]1CC2CC[C@H]1N2C#N)C(=O)[C@H]1CCN(C1)c1cc(Cl)cc(Cl)c1 |r,THB:9:8:6.5:2.3|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@H]1CCN(C1)c1nc(ccc1C#N)C(F)(F)F |r,THB:9:8:6.5:2.3|
CN(C1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@H]1CCCN1c1cc(Cl)cc(Cl)c1Cl |r,THB:9:8:6.5:2.3|
CN(C1C[C@@H]2CC[C@H]1N2C#N)C(=O)[C@@H]1CCCN1c1cc(Cl)cc(Cl)c1Cl |r,THB:9:8:6.5:2.3|
CN(CCc1cc(Cl)ccc1Cl)C(=O)N(C)[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
CN(CCc1cc(Cl)ccc1Br)C(=O)N(C)[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)c1ccc(cc1Cl)-c1cccc(n1)C1(CC1)C#N |r,THB:9:8:6.5:2.3|
CC(C)COc1cc(ccc1-c1cnn(C)c1)C(=O)N(C)[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC1(CN(CCO1)c1cc(ncn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccccc1 |r,THB:23:22:20.19:16.17|
CC1(CN(CCO1)c1cc(ncn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc(Cl)cc1 |r,THB:23:22:20.19:16.17|
CN(CC1(CC1)c1ccc(Br)cc1)c1cc(ncn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
Cc1cnn(c1)-c1ccc(C(=O)N[C@@H]2CCC3CCC2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:13.15.14|
Clc1ccc2CCN(CCC(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c2c1 |r,THB:20:19:17.16:13.14|
C\C(=C/Cc1cc(Cl)ccc1Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
Clc1ccc(Cl)c(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:20:19:17.16:13.14|
Clc1ccc(Cl)c(c1)C1CCC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Fc1ccc(Oc2cccc(c2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)cc1 |r,THB:22:21:19.18:15.16|
Clc1ccc(Cc2cccc(c2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)cc1 |r,THB:22:21:19.18:15.16|
Clc1ccc(Oc2cccc(c2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)cc1 |r,THB:22:21:19.18:15.16|
Clc1ccc(Cl)c(CC2CC2C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:21:20:18.17:14.15|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1cccc(Oc2ccc(cc2)C#N)c1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2c(c1)oc1ccccc21 |r,THB:10:9:7.6:3.4|
CCn1cc(\C=C\C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c2cc(Cl)cnc12 |r,THB:17:16:14.13:10.11|
Brc1cccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1C#N |r,THB:18:17:15.14:11.12|
O=C(CNC(=O)c1cc2CCCCc2s1)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
COC(\C=C\c1cc(Cl)ccc1Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
CN([C@@H]1C[C@@H]2CC[C@H]1N2C#N)C(=O)C\C=C\c1cc(Cl)ccc1Cl |r,THB:9:8:6.5:2.3|
Clc1ccc(Cl)c(c1)-c1cccc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cccc(\C=C\CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:19:18:16.15:12.13|
CCn1cc(\C=C(/C)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c2cc(Cl)ccc12 |r,THB:18:17:15.14:11.12|
Clc1ccc(Cl)c(\C=C\CC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:20:19:17.16:13.14|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCc2[nH]c3ccccc3c2C1 |r,THB:10:9:7.6:3.4|
C\C(=C/c1csc2ccc(Cl)cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Brc1cccc(c1)-c1cccc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
C\C(=C/c1n[nH]c2ccc(Cl)cc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Cc1ccnc(n1)-c1ccc2cc([nH]c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Clc1cccc(c1)-c1ccc(o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C1CCN(C1)c1nccc(n1)C1CC1 |r,THB:10:9:7.6:3.4|
FC(F)(F)c1cccc(c1)N1CCC(C1)C(=O)N[C@@H]1CC2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
Clc1cc(Cl)cc(c1)N1CCC(C1)C(=O)N[C@@H]1CC2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
FC(F)(F)c1cccc(n1)N1CCC(C1)C(=O)N[C@@H]1CC2CC[C@H]1N2C#N |r,THB:25:24:22.21:18.19|
CC(C)COc1c(Cl)c(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1c(Cl)c(ccc1-n1cc(C)cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-n1cc(C)cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
Cc1cccc(n1)-n1ncc2cc(cc(C)c12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1ccc2ccccc2n1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)-n1ccnc1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)-c1ccccc1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)-n1cccn1 |r,THB:10:9:7.6:3.4|
FC(F)(F)c1cccc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
FC(F)Oc1cccc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
FC(F)c1cccc(n1)-n1ncc2cc(ccc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1ccc2n(ncc2c1)-c1cccc(n1)-c1ccccn1 |r,THB:10:9:7.6:3.4|
Clc1cccc(c1)N1CC2CC2(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:16.17:20.19|
Clc1cc(Cl)cc(c1)-n1ccc(n1)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C#N |r,THB:23:22:16.17:20.19|
Clc1cc(Cl)cc(c1)N1C[C@@H]([C@@H]2C[C@H]12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:17.18:21.20|
Clc1cc(Cl)cc(c1)N1C[C@H]([C@@H]2C[C@H]12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:17.18:21.20|
Clc1cc(Cl)cc(c1)N1CCCC(CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:18.19:22.21|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C#N |r,THB:20:19:13.14:17.16|
Clc1cc2n(ncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cc(ccn1)C#N |r,THB:20:19:13.14:17.16|
Cn1cc(cn1)-c1cnc(s1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:21:20:14.15:18.17|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1csc(n1)-c1cccc(c1)C#N |r,THB:10:9:3.4:7.6|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1csc(n1)-c1cccc(c1)C1CC1 |r,THB:10:9:3.4:7.6|
Cc1ccnc(n1)-c1cccc2c(c[nH]c12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:19.20:23.22|
Cc1cccc(n1)-c1cccc2c(c[nH]c12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:19.20:23.22|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(CC#N)c1Cl |r,THB:17:16:10.11:14.13|
Clc1cc(CC#N)cc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Clc1ccc(CC#N)cc1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Clc1ccc(cc1CC#N)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
CC(C)(C#N)c1cccc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:25:24:18.19:22.21|
Fc1cc(CC#N)cc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Fc1ccc(cc1CC#N)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(CC#N)c1 |r,THB:17:16:10.11:14.13|
Fc1ccc(CC#N)cc1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
CC(C)(C#N)c1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:25:24:18.19:22.21|
Cc1ccc(CC#N)cc1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Cc1ccc(cc1CC#N)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Cc1cc(CC#N)cc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:17.18:21.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(c1)C1(CCC1)C#N |r,THB:17:16:10.11:14.13|
COCc1cccc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:23:22:16.17:20.19|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc(CC#N)cc1 |r,THB:17:16:10.11:14.13|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cncc(c1)C1(CC1)C#N |r,THB:17:16:10.11:14.13|
CN(C(C)=O)c1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:25:24:22.21:18.19|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cncc(CC#N)c1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cc(CC#N)ccn1 |r,THB:17:16:14.13:10.11|
Cc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CC1)C#N |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(c1)C1(CC1)C#N |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccnc1CC#N |r,THB:17:16:14.13:10.11|
FC(F)(F)c1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CC1)C#N |r,THB:20:19:17.16:13.14|
Fc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CC1)C#N |r,THB:17:16:14.13:10.11|
Cn1ccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(c1)C(F)(F)F |r,THB:20:19:17.16:13.14|
FC(F)(F)c1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2cncn2c1 |r,THB:20:19:17.16:13.14|
Cn1ccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(F)c1 |r,THB:20:19:17.16:13.14|
Fc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2cncn2c1 |r,THB:17:16:14.13:10.11|
Cn1ccc(n1)-c1cc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Clc1cc(cc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2cncn2c1 |r,THB:18:17:15.14:11.12|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ncc(cn1)C#N |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1nccc(n1)C#N |r,THB:17:16:14.13:10.11|
Cc1cncc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Cc1cnc(cn1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cc(ccn1)C#N |r,THB:17:16:14.13:10.11|
Cc1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Cc1nccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Cc1ccc(nn1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
FC(F)c1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:23:22:20.19:16.17|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(CC#N)n1 |r,THB:17:16:14.13:10.11|
FC(F)Oc1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:21.20:17.18|
CC(F)(F)c1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:21.20:17.18|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cncc(n1)C1CC1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C#N |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cccc(n1)C1(CC1)C#N |r,THB:17:16:14.13:10.11|
FC(F)(F)COc1cccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:26:25:23.22:19.20|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2nccn2c1 |r,THB:17:16:14.13:10.11|
Cn1ncc2cccc(-c3ccc(C(=O)N[C@@H]4C[C@@H]5CC[C@H]4N5C#N)c(Cl)c3)c12 |r,THB:23:22:20.19:16.17|
Cc1cc2nccn2cc1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:21.20:17.18|
Cc1cn2cc(ccc2n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:24:23:21.20:17.18|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccn2ccnc2c1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1ccc2cncn2c1 |r,THB:17:16:14.13:10.11|
Cn1ccc(n1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:20:19:17.16:13.14|
Cn1nccc1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:20:19:17.16:13.14|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cnn(c1)C1CC1 |r,THB:17:16:14.13:10.11|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cnn(CC#N)c1 |r,THB:17:16:14.13:10.11|
Cn1cnc(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:20:19:17.16:13.14|
Cn1cc(cn1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:20:19:17.16:13.14|
CC(C)COc1cc(ccc1-c1cc(ccn1)C#N)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
CC(C)COc1cc(ccc1-c1cnc(C)cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-c1cccc(C)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-c1nccc(C)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-c1cccc(CC#N)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:30:29:27.26:23.24|
CC(C)COc1cc(ccc1-c1ccn(C)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
CC(C)COc1cc(ccc1-c1ccnn1C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
CC(C)COc1cc(ccc1-c1cn(C)cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|
CC(C)COc1cc(ccc1-c1cccc(n1)C#N)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
CC(C)COc1cc(ccc1-c1ccc(C)nn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-c1ccnc(C)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CCC(C)COc1cc(ccc1-c1cnn(C)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CCn1cc(cn1)-c1ccc(cc1OCC(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
CC(C)COc1cc(ccc1-c1cnn(c1)C1CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
Cc1cccc(n1)-n1ncc2cc(cc(c12)C(F)(F)F)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:30:29:27.26:23.24|
Clc1ccc(Cl)c(CNC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1 |r,THB:19:18:16.15:12.13|
Cc1c(Br)cccc1C1CCCN1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Clc1cccc(C2CCN2C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1Cl |r,THB:20:19:17.16:13.14|
CC(C)C1CC(CNC(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c2ccccc12 |r,THB:18:17:15.14:11.12|
CC(NC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)c1cccc(Cl)c1Cl |r,THB:13:12:10.9:6.7|
Clc1ccc2CCCC(CNC(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c2c1 |r,THB:21:20:18.17:14.15|
Clc1cccc(C2CCCN2C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1Cl |r,THB:21:20:18.17:14.15|
Clc1ccc2OCCN(CNC(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)Cc2c1 |r,THB:21:20:18.17:14.15|
Clc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
OCCN(CC12CC3CC(CC(C3)C1)C2)C(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,TLB:8:9:13:7.12.6,12:7:14:13.11.10,12:11:14:7.8.6,THB:8:7:13:14.9.10,27:26:24.23:20.21|
CCc1cnn(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:21:20:18.17:14.15|
Clc1cc(ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-n1cc(CC#N)cn1 |r,THB:17:16:14.13:10.11|
FC(F)(F)c1cnn(c1)-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c(Cl)c1 |r,THB:23:22:20.19:16.17|
Clc1cccc(c1)N1C[C@@H](CC1=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:19.20:16.17|
Clc1cccc(c1)N1C[C@H](CC1=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:19.20:16.17|
Clc1cccc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
Clc1cccc(c1)N1CC[C@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:18.19:15.16|
Brc1ccc2C[C@@H](Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:20:19:16.17:13.14|
Brc1ccc2C[C@H](Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:20:19:16.17:13.14|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@@H]1CCN(C1)c1nccc(n1)C1CC1 |r,THB:10:9:6.7:3.4|
FC(F)(F)c1ccnc(n1)N1CC[C@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:21.22:18.19|
FC(F)(F)c1ccnc(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:21.22:18.19|
Clc1cc(Cl)cc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:19.20:16.17|
Clc1ccc(C#N)c(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:20.21:17.18|
FC(F)(F)c1cc(nc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:25:24:21.22:18.19|
Cc1cc(nc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:22:21:18.19:15.16|
Cc1cc(nc(c1)C(F)(F)F)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:22.23:19.20|
FC(F)(F)c1cc(cc(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:25:24:21.22:18.19|
FC(F)(F)c1ccc(C#N)c(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:21.20:23.24|
FC(F)(F)c1cncc(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:21.22:18.19|
FC(F)(F)c1ccc(Cl)c(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:22.23:19.20|
Cc1cccc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:16.15|
COc1cccc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:17.16|
Clc1ccc2OCCC(=Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,c:8,THB:22:21:15.16:18.19|
Clc1ccc(Cl)c(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:16.17:19.20|
FC(F)(F)Oc1c(Cl)cc(cc1Cl)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:21.22:24.25|
FC(F)(F)c1cc(Cl)cc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:19.20:22.23|
Cc1cc(Cl)cc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:16.17:19.20|
Cc1ccc(Cl)cc1N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:16.17:19.20|
Clc1cccc(c1)-c1cccc(n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
Clc1ccc(Cl)c(c1)-c1ccnc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cc(Cl)cc(c1)-c1ccnc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:21.20:17.18|
Clc1cccc(c1)-c1ccnc(c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:20.19:16.17|
COc1c(Cl)cc(cc1Cl)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:25:24:18.19:21.22|
Fc1c(Cl)cc(cc1Cl)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:17.18:20.21|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCN(C1)c1cccc(c1)C1CC1 |r,THB:10:9:7.6:3.4|
Clc1cc(Cl)cc(c1)N1CCOC(C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:20.21:18.17|
Clc1cc(Cl)c(Cl)c(n1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:17.18:20.21|
Clc1cc(Cl)cc(c1)-n1cc(cn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:19.20:16.17|
Clc1nn(cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)-c1cc(Cl)cc(Cl)c1 |r,THB:16:15:12.13:9.10|
Clc1cc(cc(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:22:21:18.19:15.16|
Clc1ccc(cc1N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)C#N |r,THB:22:21:18.19:15.16|
CC(C)n1cc(cc(N2CC[C@@H](C2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1=O)C(F)(F)F |r,THB:23:22:19.20:16.17|
Clc1ccc(cc1Cl)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
Clc1cccc(N2CC[C@@H](C2)C(=O)N[C@@H]2C[C@@H]3CC[C@H]2N3C#N)c1Cl |r,THB:21:20:15.14:18.17|
FC(F)(F)c1ccc(Cl)c(c1)N1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:20.19:23.22|
Clc1cc(Cl)cc(c1)N1C[C@H]([C@H]2C[C@@H]12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
Clc1cc(Cl)cc(c1)N1C[C@H]([C@@H]2C[C@H]12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
Clc1ccc2[nH]c3CC[C@H](Cc3c2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:24:23:18.17:21.20|
Clc1ccc(Cl)c(c1)[C@@H]1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
Clc1ccc(Cl)c(c1)[C@H]1CC[C@@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
Clc1ccc(Cl)c(c1)[C@H]1CC[C@H](C1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:23:22:17.16:20.19|
FC(F)(F)c1cccc(n1)-n1ncc2C[C@@H](CCc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:23.22:26.25|
FC(F)Oc1cccc(n1)-n1ncc2C[C@@H](CCc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:23.22:26.25|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCc2nn(cc2C1)-c1cccc(n1)C1(CC1)C#N |r,THB:10:9:4.3:7.6|
CC(F)(F)c1cccc(n1)-n1cc2C[C@H](CCc2n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
CC(F)(F)c1cccc(n1)-n1cc2C[C@@H](CCc2n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
FC(F)Oc1cccc(n1)-n1cc2C[C@@H](CCc2n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:29:28:26.25:22.23|
FC(F)c1cccc(n1)-n1cc2C[C@@H](CCc2n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:28:27:25.24:21.22|
Clc1ccc2OCCN(Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
Clc1ccc2NCCN(Cc2c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:22:21:19.18:15.16|
CC(=O)Nc1cccc(n1)-n1ncc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H]3N4C#N)c(Cl)cc12 |r,THB:26:25:23.22:19.20|
Cc1cccc(n1)-n1ncc2C[C@@H](CCc12)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
Cc1cccc(n1)-n1cc2C[C@@H](CCc2n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:26:25:23.22:19.20|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@H]1CCc2nn(cc2C1)-c1cccc(n1)C1CC1 |r,THB:10:9:7.6:3.4|
O=C(N[C@@H]1C[C@@H]2CC[C@H]1N2C#N)[C@@H]1CCc2nn(cc2C1)-c1cccc(n1)C1CC1 |r,THB:10:9:7.6:3.4|
CC(C)COc1cc(ccc1-n1ccc(C)n1)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C#N |r,THB:27:26:24.23:20.21|