pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.31	IUPAC digitized pKa	1	0	Cc1nc(N)[nH+]c(C)c1C(N)=O,Cc1nc([NH3+])nc(C)c1C(N)=O	Cc1nc(N)nc(C)c1C(N)=O	mol2523	Cc1nc(N)nc(C)c1C(N)=O
3.11	OCHEM	1	0	Cc1nc(N)[nH+]c(C)c1C(N)=O,Cc1nc([NH3+])nc(C)c1C(N)=O	Cc1nc(N)nc(C)c1C(N)=O	mol2523	Cc1nc(N)nc(C)c1C(N)=O
3.30999994277954	QSARToolbox	1	0	Cc1nc(N)[nH+]c(C)c1C(N)=O,Cc1nc([NH3+])nc(C)c1C(N)=O	Cc1nc(N)nc(C)c1C(N)=O	mol2523	Cc1nc(N)nc(C)c1C(N)=O