pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.6	IUPAC digitized pKa	1	0	Cc1[nH+]c(N)ncc1C(N)=O,Cc1nc([NH3+])ncc1C(N)=O,Cc1nc(N)[nH+]cc1C(N)=O	Cc1nc(N)ncc1C(N)=O	mol7010	Cc1nc(N)ncc1C(N)=O
2.59999990463257	QSARToolbox	1	0	Cc1[nH+]c(N)ncc1C(N)=O,Cc1nc([NH3+])ncc1C(N)=O,Cc1nc(N)[nH+]cc1C(N)=O	Cc1nc(N)ncc1C(N)=O	mol7010	Cc1nc(N)ncc1C(N)=O