pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.32	IUPAC digitized pKa	0	-1	CN(C)C(=S)SCC(=O)O	CN(C)C(=S)SCC(=O)[O-]	mol9503	CN(C)C(=S)SCC(=O)O
3.38	IUPAC digitized pKa	0	-1	CN(C)C(=S)SCC(=O)O	CN(C)C(=S)SCC(=O)[O-]	mol9503	CN(C)C(=S)SCC(=O)O
3.34	Datawarrior	0	-1	CN(C)C(=S)SCC(=O)O	CN(C)C(=S)SCC(=O)[O-]	mol9503	CN(C)C(=S)SCC(=O)O
3.3399999	OCHEM	0	-1	CN(C)C(=S)SCC(=O)O	CN(C)C(=S)SCC(=O)[O-]	mol9503	CN(C)C(=S)SCC(=O)O
3.3199999332428	QSARToolbox	0	-1	CN(C)C(=S)SCC(=O)O	CN(C)C(=S)SCC(=O)[O-]	mol9503	CN(C)C(=S)SCC(=O)O