Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol14741 CC(C)(S)C(C(=O)O)n1ccnc1Cc1ccccc1 4 4
mol14742 CCCCCCCCc1c(-c2ccccc2)n[nH]c1O 2 3
mol14743 CN(C)CCOC(C)(c1ccccc1)c1ccccn1 2 2
mol14744 CCOC(=O)c1ccccc1-n1nc(O)c(CC)c1C 0 0
mol14745 CCN1CCCC1CNC(=O)c1c(O)cccc1OC 2 3
mol14746 CCN(CC)Cc1cc([N+](=O)[O-])c2ccccc2c1O 3 3
mol14747 CC(C)N(CCc1ccccc1)CCc1ccccc1 2 2
mol14748 Cc1cc(Cc2cc([N+](=O)[O-])ccc2O)cc(C)c1O 3 4
mol14749 Cc1cc(Cc2cc(O)ccc2C)c(O)c([N+](=O)[O-])c1 3 4
mol14750 Cc1ccc(O)c(Cc2cc(C)cc([N+](=O)[O-])c2O)c1 3 4
mol14751 Cc1ccc(Sc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 2 2
mol14752 CCN(CC)CCOC(=O)c1ccc2ccccc2c1 2 2
mol14753 CC(C(=O)c1ccc(O)cc1)N(C)Cc1ccccc1 2 3
mol14754 O=S(=O)(Nc1cccc(C(F)(F)F)c1)c1ccccc1 2 2
mol14755 Cc1ccc(C(OCCN(C)C)c2ccccc2)cc1 2 2
mol14756 CC(C)CN[C@H](c1ccccc1)[C@H](O)c1ccccc1 2 2
mol14757 CN(C)CCOC(C)(c1ccccc1)c1ccccc1 2 2
mol14758 O=C(O)c1cc([N+](=O)[O-])ccc1C(=O)c1ccccc1 2 2
mol14759 O=C(c1ccccc1)c1cccc([N+](=O)[O-])c1C(=O)O 2 2
mol14760 O=C(O)c1cccc([N+](=O)[O-])c1C(=O)c1ccccc1 2 2