Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol15381 O=C(CC(=O)c1ccccc1)Nc1cccc([N+](=O)[O-])c1 2 3
mol15382 O=C(CC(=O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] 2 3
mol15383 O=C(CC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1 2 3
mol15384 O=C(CC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 2 3
mol15385 CC/C=C/CC(=O)N[C@H]1C(=O)N2[C@H]1SC(C)(C)[C@H]2C(=O)O 2 3
mol15386 CN(C)c1cccc2c(S(=O)(=O)NCC(=O)O)cccc12 3 5
mol15387 CC/C=C/CC1=NC(C(=O)O)C2SC(C)(C)C(C(=O)O)N12 0 0
mol15388 CCCCCCCCCc1c(O)n[nH]c1-c1ccccc1 2 3
mol15389 CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C 2 2
mol15390 CN(C)CCC/N=C(\c1ccccc1)c1ccccc1O 3 6
mol15391 CC(=O)c1ccccc1NN=C1C(=O)CC(C)(C)CC1=O 2 2
mol15392 COc1c(Cl)cc(Cl)c(O)c1C(=O)NC1CCN(C)CC1 3 3
mol15393 Cc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1C 2 2
mol15394 CCN1CCCC1CNC(=O)c1c(OC)ccc(Cl)c1O 3 3
mol15395 N#CC(C#N)=NNc1ccc(/N=N/c2ccccc2)cc1 4 11
mol15396 N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O 5 9
mol15397 Cc1cc(Cc2cc(C)c(O)c(C)c2)c(O)c([N+](=O)[O-])c1 3 4
mol15398 CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccccc2)cc1 2 2
mol15399 Cc1ccc(S(=O)(=O)NC(=O)OCc2ccccc2)cc1 2 2
mol15400 O=C(CCNCCC(=O)c1ccccc1)c1ccccc1 2 2