pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.0	QSARToolbox	1	0	Cc1ccc(O)c2[n+]1C[C@@H](C(=O)O)S2	Cc1ccc(O)c2[n+]1C[C@@H](C(=O)[O-])S2	mol35586	Cc1ccc(O)c2[n+]1CC(C(=O)O)S2