pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.9	OCHEM	0	-1	COC(=O)C[C@H]1c2ccc(Cl)cc2NC(=O)[C@@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	COC(=O)C[C@H]1c2ccc(Cl)cc2[N-]C(=O)[C@@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1,COC(=O)C[C@H]1c2ccc(Cl)cc2NC(=O)[C-]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	mol21032	COC(=O)CC1c2ccc(Cl)cc2NC(=O)C1S(=O)(=O)c1ccc([N+](=O)[O-])cc1