Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol36782 O=C(CCCN1CCC(O)(c2ccc(F)cc2)CC1)c1ccccc1 2 2
mol36783 O=C1C=C/C(=C(\c2ccc(O)c(O)c2)c2ccccc2S(=O)(=O)O)C=C1O 2 6
mol36784 OC1=Cc2cc(Cl)ccc2CC1 0 0
mol36785 O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)CCC(O)=C2 0 0
mol36786 O=[N+]([O-])c1ccc2c(c1)C=C(O)CC2 0 0
mol36787 OC1=Cc2ccc(Cl)cc2CC1 0 0
mol36788 OC1=Cc2ccc(I)cc2CC1 0 0
mol36789 O=[N+]([O-])c1ccc2c(c1)CCC(O)=C2 0 0
mol36790 O=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(O)c2)C1O 2 14
mol36791 O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O 2 2
mol36792 O=P(O)(O)C(F)(F)C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O 2 2
mol36793 O=P(O)(O)CC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O 2 2
mol36794 O=P(O)(O)[C@H](F)C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O 2 2
mol36795 O=C1C(O)Oc2cc(Cl)ccc2N1O 2 2
mol36796 O=C1C(O)Oc2cc(F)ccc2N1O 2 2
mol36797 O=C1C(O)Oc2cc([N+](=O)[O-])ccc2N1O 2 3
mol36798 O=C1C(O)Oc2ccccc2N1O 2 2
mol36799 O=[N+]([O-])C(CC(CO)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] 2 2
mol36800 O=C(O)CCOCC(CO)(COCCC(=O)O)COCCC(=O)O 2 2
mol36801 OCC(F)C(F)(F)C(F)(F)C(F)(F)F 2 2