pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.9	Datawarrior	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1
3.64	Datawarrior	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1
3.6400001	OCHEM	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1
2.9000001	OCHEM	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1
3.48000001907349	QSARToolbox	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1
3.80999994277954	QSARToolbox	0	-1	O=C([O-])c1csc[nH+]1,O=C(O)c1cscn1	O=C([O-])c1cscn1	mol12412	O=C(O)c1cscn1