pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.95	Datawarrior	0	-1	CCN(CC)C(=S)S	CCN(CC)C(=S)[S-]	mol12478	CCN(CC)C(=S)S
3.95000004768372	QSARToolbox	0	-1	CCN(CC)C(=S)S	CCN(CC)C(=S)[S-]	mol12478	CCN(CC)C(=S)S