pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.46	IUPAC digitized pKa	0	-1	OC[C@H](O)CS	OC[C@H](O)C[S-]	mol9071	OCC(O)CS
9.51	IUPAC digitized pKa	0	-1	OC[C@H](O)CS	OC[C@H](O)C[S-]	mol9071	OCC(O)CS
9.51000022888184	QSARToolbox	0	-1	OC[C@H](O)CS	OC[C@H](O)C[S-]	mol9071	OCC(O)CS
9.65999984741211	QSARToolbox	0	-1	OC[C@H](O)CS	OC[C@H](O)C[S-]	mol9071	OCC(O)CS