pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.20000004768372	QSARToolbox	1	0	O=C(O)[C@@H]1CSc2c(O)ccc[n+]21	O=C([O-])[C@@H]1CSc2c(O)ccc[n+]21	mol35993	O=C(O)C1CSc2c(O)ccc[n+]21