pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.8199996948242	QSARToolbox	-1	-2	[S-]CCCCCS	[S-]CCCCC[S-]	mol28193	SCCCCCS
11.82	AttenGpKa training set	-1	-2	[S-]CCCCCS	[S-]CCCCC[S-]	mol28193	SCCCCCS
13.27	AttenGpKa training set	-1	-2	[S-]CCCCCS	[S-]CCCCC[S-]	mol28193	SCCCCCS