Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol17481 Nc1nc(N)c2nc(-c3ccccc3)c(N)nc2n1 2 8
mol17482 CNCCCC1c2ccccc2C=Cc2ccccc21 2 2
mol17483 O=C(NCCNCC(O)COc1ccc(O)cc1)N1CCOCC1 2 3
mol17484 Nc1cc(-c2ccncc2)c[nH]c1=O 2 3
mol17485 O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5 4 7
mol17486 CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 2 3
mol17487 Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O 2 2
mol17488 Cc1ccc(C)c(OCCCC(C)(C)C(=O)O)c1 2 2
mol17489 CCCNC1CCc2nc(N)sc2C1 2 2
mol17490 CCNC(C)Cc1cccc(C(F)(F)F)c1 2 2
mol17491 COc1cc2nc(N3CCN(C(=O)C4CCCO4)CC3)nc(N)c2cc1OC 2 5
mol17492 OC(CCN1CCCC1)(c1ccccc1)C1CCCCC1 2 2
mol17493 CNC(=C[N+](=O)[O-])NCCSCc1csc(CN(C)C)n1 2 2
mol17494 CCC(=O)O[C@](Cc1ccccc1)(c1ccccc1)[C@H](C)CN(C)C 2 2
mol17495 CCC(C)(C)NCC(O)COc1ccccc1C(=O)CCc1ccccc1 2 2
mol17496 CCc1cccc2cc(C(O)CNC(C)(C)C)oc12 3 3
mol17497 CC(C)NC[C@H](O)COc1ccc(O)cc1 2 3
mol17498 CCC1C2CC3C4N(C)c5ccccc5C45CC(C2[C@H]5O)N3C1O 2 2
mol17499 CN1CCCC1CCOC(C)(c1ccccc1)c1ccc(Cl)cc1 2 2
mol17500 CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1 5 10