pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.2	IUPAC digitized pKa	0	-1	Oc1ccc(/N=N/c2ccccc2)cc1	[O-]c1ccc(/N=N/c2ccccc2)cc1	mol1109	Oc1ccc(/N=N/c2ccccc2)cc1
8.44	Datawarrior	0	-1	Oc1ccc(/N=N/c2ccccc2)cc1	[O-]c1ccc(/N=N/c2ccccc2)cc1	mol1109	Oc1ccc(/N=N/c2ccccc2)cc1
8.19999980926514	QSARToolbox	0	-1	Oc1ccc(/N=N/c2ccccc2)cc1	[O-]c1ccc(/N=N/c2ccccc2)cc1	mol1109	Oc1ccc(/N=N/c2ccccc2)cc1
8.396666667	AttenGpKa training set	0	-1	Oc1ccc(/N=N/c2ccccc2)cc1	[O-]c1ccc(/N=N/c2ccccc2)cc1	mol1109	Oc1ccc(/N=N/c2ccccc2)cc1
-0.93	AttenGpKa training set	1	0	Oc1ccc(/[NH+]=N/c2ccccc2)cc1,Oc1ccc(/N=[NH+]/c2ccccc2)cc1	Oc1ccc(/N=N/c2ccccc2)cc1	mol1109	Oc1ccc(/N=N/c2ccccc2)cc1