pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.35	Datawarrior	0	-1	Oc1ccc2cn[nH]c2c1	[O-]c1ccc2cn[nH]c2c1	mol13168	Oc1ccc2cn[nH]c2c1
9.3500004	OCHEM	0	-1	Oc1ccc2cn[nH]c2c1	[O-]c1ccc2cn[nH]c2c1	mol13168	Oc1ccc2cn[nH]c2c1
9.35000038146973	QSARToolbox	0	-1	Oc1ccc2cn[nH]c2c1	[O-]c1ccc2cn[nH]c2c1	mol13168	Oc1ccc2cn[nH]c2c1
