pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.5	Baltruschat ChEMBL	0	-1	COc1ccc(O)c(/C=N/NS(=O)(=O)Cc2ccccc2)c1	COc1ccc([O-])c(/C=N/NS(=O)(=O)Cc2ccccc2)c1,COc1ccc(O)c(/C=N/[N-]S(=O)(=O)Cc2ccccc2)c1	mol17228	COc1ccc(O)c(/C=N/NS(=O)(=O)Cc2ccccc2)c1