pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.1	IUPAC digitized pKa	0	-1	Nc1nc(O)nc(-c2ccccc2)n1	Nc1nc([O-])nc(-c2ccccc2)n1	mol7611	Nc1nc(O)nc(-c2ccccc2)n1
3.0	IUPAC digitized pKa	1	0	[NH3+]c1nc(O)nc(-c2ccccc2)n1,Nc1nc(O)[nH+]c(-c2ccccc2)n1,Nc1nc(O)nc(-c2ccccc2)[nH+]1,Nc1nc(-c2ccccc2)nc(O)[nH+]1	Nc1nc(O)nc(-c2ccccc2)n1	mol7611	Nc1nc(O)nc(-c2ccccc2)n1