Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol15401 CC1=C(CC(C)NCC(O)c2ccccc2)CCC1(C)C 2 2
mol15402 CCCCOc1ccc(OCCCN2CCOCC2)cc1 2 2
mol15403 N#Cc1ccc(O[C@H]2O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]2O)cc1 2 2
mol15404 CCc1ccc(/N=N/c2ccc(N(C)C)cc2)cc1CC 2 3
mol15405 Nc1ccc(P(=O)(Nc2nccs2)OCC(F)(F)F)cc1 2 2
mol15406 COc1cc(OC)nc(NS(=O)(=O)c2ccc(O)cc2)n1 2 3
mol15407 CC[C@]12CCCN3CCc4c(n(c5ccccc45)CC1)[C@@H]32 2 2
mol15408 c1ccc2c(c1)[nH]c1c2cc[n+]2cc3c(cc12)CCCC3 2 2
mol15409 COc1ccc2c3c1O[C@H]1CCC[C@H]4[C@@H](C2)N(C)CC[C@]314 2 2
mol15410 COc1ccc2c3c1O[C@H]1CCC[C@H]4[C@H](NCC[C@]314)[C@H]2O 2 2
mol15411 COc1ccc2c3c1O[C@H]1CCC[C@H]4[C@H](NCC[C@]314)[C@@H]2O 2 2
mol15412 CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)CC[C@H]3[C@H]1C5 2 3
mol15413 C/C(=C\c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)O 2 2
mol15414 CSSC(CCO)=C(C)N(C=O)Cc1cnc(C)nc1N 2 4
mol15415 CC/C=C/Cc1nc(C(=O)O)cn1C(C(=O)O)C(C)(C)S 3 5
mol15416 O=C(O)CN(CCNS(=O)(=O)c1ccccc1)CC(=O)O 3 6
mol15417 NNC(=O)C1(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F 2 2
mol15418 CCCCCCCN(CCCCCCC)c1ccccc1 2 2
mol15419 C=C/C(C)=C/[C@@H](C)C(=O)C[C@@H](O)CC1CC(=O)NC(=O)C1 2 4
mol15420 C[C@@H](O)[C@H](CCC=O)O[C@H]1O[C@H](C)[C@@H](N(C)C)[C@H](O)[C@H]1O 2 2