pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.7	Baltruschat ChEMBL	-1	-2	Cc1ccc([O-])c(-c2ccc(/C=C3\SC(=O)NC3=O)o2)c1	Cc1ccc([O-])c(-c2ccc(/C=C3\SC(=O)[N-]C3=O)o2)c1	mol17810	Cc1ccc(O)c(-c2ccc(/C=C3\SC(=O)NC3=O)o2)c1