pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.85999965667725	QSARToolbox	0	-1	Nc1ccc(S)cc1	Nc1ccc([S-])cc1	mol28186	Nc1ccc(S)cc1
7.6	AttenGpKa training set	0	-1	Nc1ccc(S)cc1	Nc1ccc([S-])cc1	mol28186	Nc1ccc(S)cc1