pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.0	OCHEM	0	-1	COC(=O)C[C@H]1c2ccc(Cl)cc2NC(=O)[C@H]1S(C)(=O)=O	COC(=O)C[C@H]1c2ccc(Cl)cc2[N-]C(=O)[C@H]1S(C)(=O)=O,COC(=O)C[C@H]1c2ccc(Cl)cc2NC(=O)[C-]1S(C)(=O)=O	mol32239	COC(=O)CC1c2ccc(Cl)cc2NC(=O)C1S(C)(=O)=O