pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.03	IUPAC digitized pKa	0	-1	Oc1ccnc2cccnc12	[O-]c1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
10.01	Datawarrior	0	-1	Oc1ccnc2cccnc12	[O-]c1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
10.0100002288818	QSARToolbox	0	-1	Oc1ccnc2cccnc12	[O-]c1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
2.81	IUPAC digitized pKa	1	0	Oc1ccnc2ccc[nH+]c12,Oc1cc[nH+]c2cccnc12	Oc1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
2.85	Datawarrior	1	0	Oc1ccnc2ccc[nH+]c12,Oc1cc[nH+]c2cccnc12	Oc1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
2.8499999	OCHEM	1	0	Oc1ccnc2ccc[nH+]c12,Oc1cc[nH+]c2cccnc12	Oc1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12
2.84999990463257	QSARToolbox	1	0	Oc1ccnc2ccc[nH+]c12,Oc1cc[nH+]c2cccnc12	Oc1ccnc2cccnc12	mol2477	Oc1ccnc2cccnc12