pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.3	Baltruschat ChEMBL	1	0	O=S(=O)([NH2+]c1ccccc1-c1nccc2ccccc12)c1ccc(Cl)cc1,O=S(=O)(Nc1ccccc1-c1[nH+]ccc2ccccc12)c1ccc(Cl)cc1	O=S(=O)(Nc1ccccc1-c1nccc2ccccc12)c1ccc(Cl)cc1	mol16381	O=S(=O)(Nc1ccccc1-c1nccc2ccccc12)c1ccc(Cl)cc1