pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.52	Baltruschat ChEMBL	0	-1	NS(=O)(=O)c1cc2c(s1)C[C@@H](O)CS2(=O)=O	[NH-]S(=O)(=O)c1cc2c(s1)C[C@@H](O)CS2(=O)=O	mol16502	NS(=O)(=O)c1cc2c(s1)CC(O)CS2(=O)=O