pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.33	IUPAC digitized pKa	0	-1	Oc1ccc(S)cc1	Oc1ccc([S-])cc1	mol10802	Oc1ccc(S)cc1
7.3	IUPAC digitized pKa	0	-1	Oc1ccc(S)cc1	Oc1ccc([S-])cc1	mol10802	Oc1ccc(S)cc1
6.85	AttenGpKa training set	0	-1	Oc1ccc(S)cc1	Oc1ccc([S-])cc1	mol10802	Oc1ccc(S)cc1
12.4	AttenGpKa training set	-1	-2	Oc1ccc([S-])cc1	[O-]c1ccc([S-])cc1	mol10802	Oc1ccc(S)cc1