Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol15421 CC(C)(C)OC(=O)NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1 2 2
mol15422 O=C(C1=C(O)C(=O)c2ccccc2C1=O)c1ccccc1 2 2
mol15423 O=C1C(O)=C(/C=C/c2ccccc2)C(=O)c2ccccc21 2 2
mol15424 CC1(C)C=CC(C)(c2cc3ccc(=O)oc3cc2O)CC1 2 2
mol15425 COc1cc([S+](C)[O-])ccc1-c1nc2ncc(N)cc2[nH]1 2 4
mol15426 c1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1 3 5
mol15427 Cc1nn(C)c2c1C(c1ccccc1F)=NCC(=O)N2C 2 3
mol15428 Cc1nc(-c2ccccc2SCc2ccccc2)[nH]c1C 2 2
mol15429 O=[N+]([O-])c1cc(CN2CCOCC2)c(O)c2ccccc12 3 3
mol15430 Cc1cc(-c2ccccc2)n(-c2ccc(C(=O)O)cc2)n1 2 2
mol15431 CCCc1c(-c2ccccc2)nn(-c2ccccc2)c1O 2 2
mol15432 Cc1ccc2c(c1)ncn2[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O 2 2
mol15433 O=C(O)c1ccccc1-n1nc(O)cc1-c1ccccc1 0 0
mol15434 O=[N+]([O-])c1cc(CN2CCCCC2)c(O)c2ccccc12 3 3
mol15435 CC(C=C(c1cccs1)c1cccs1)N1CCCCCC1 2 2
mol15436 CCOC(=O)c1cnc2cc3c(cc2c1OCC)OCO3 2 2
mol15437 CN1[C@@H]2CC[C@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 2 2
mol15438 COc1ccc(-c2cnc(-c3ccc(OC)cc3)o2)cc1 2 2
mol15439 CN(C)c1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O 2 5
mol15440 CSc1nc(N)c2c(ncn2[C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)n1 2 5