Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol15321 Cc1ccc(C(O)C(C(=O)O)c2ccc(-c3ccccc3)cc2)cc1 2 2
mol15322 Cc1ccc(C(O)C(C(=O)O)c2ccc(C3CCCCC3)cc2)cc1 2 2
mol15323 CC(O)(c1ccccc1)C(C(=O)O)c1ccc(-c2ccccc2)cc1 2 2
mol15324 Cc1cccc(C(O)C(C(=O)O)c2ccc(-c3ccccc3)cc2)c1 2 2
mol15325 Cc1ccccc1C(O)C(C(=O)O)c1ccc(-c2ccccc2)cc1 2 2
mol15326 O=C(O)[C@@H]1O[C@H](Oc2ccc(-c3ccccc3)cc2)[C@@H](O)[C@H](O)[C@H]1O 2 2
mol15327 c1c(CN2CCNCCNCC2)n[nH]c1CN1CCNCCNCC1 6 26
mol15328 Cc1ccc([N+](=O)[O-])c2c(NCCCN(C)C)c3ccccc3nc12 2 5
mol15329 CN(C)CCCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12 2 5
mol15330 CN(C)CCCNc1c2ccccc2nc2c(Cl)ccc([N+](=O)[O-])c12 2 4
mol15331 CN(C)CCCNc1c2ccccc2nc2c(F)ccc([N+](=O)[O-])c12 2 5
mol15332 FC(F)(F)c1cc(-c2ccccc2)nnc1NCCN1CCOCC1 3 5
mol15333 Cc1ccccc1C(=NCCCN(C)C)c1ccc2ccccc2c1 3 4
mol15334 Cc1ccccc1C(=NCCCN(C)C)c1cccc2ccccc12 3 4
mol15335 CN1CCCN(C)Cc2ccccc2OCCOc2ccccc2C1 3 3
mol15336 CCCCCCCc1c(-c2ccccc2)nn(-c2ccccc2)c1O 2 2
mol15337 Cc1ccc(OCC(=O)N[C@H]2C(=O)N3[C@H]2SC(C)(C)[C@H]3C(=O)O)cc1 2 2
mol15338 O=C([CH-]c1ccccc1)c1cc[n+](Cc2cccc([N+](=O)[O-])c2)cc1 2 2
mol15339 O=C(Cc1ccccc1)c1cc[n+](Cc2ccc([N+](=O)[O-])cc2)cc1 0 0
mol15340 O=C(Cc1ccccc1)c1cc[n+](Cc2cccc([N+](=O)[O-])c2)cc1 0 0