pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.46	IUPAC digitized pKa	0	-1	Cn1nc(O)ccc1=O	Cn1nc([O-])ccc1=O	mol6960	Cn1nc(O)ccc1=O
5.65	Datawarrior	0	-1	Cn1nc(O)ccc1=O	Cn1nc([O-])ccc1=O	mol6960	Cn1nc(O)ccc1=O
5.6500001	OCHEM	0	-1	Cn1nc(O)ccc1=O	Cn1nc([O-])ccc1=O	mol6960	Cn1nc(O)ccc1=O
-1.32	IUPAC digitized pKa	1	0	Cn1[nH+]c(O)ccc1=O	Cn1nc(O)ccc1=O	mol6960	Cn1nc(O)ccc1=O