pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.65	IUPAC digitized pKa	0	-1	Nc1ccc(O)nc1	Nc1ccc([O-])nc1	mol6371	Nc1ccc(O)nc1
11.6499996185303	QSARToolbox	0	-1	Nc1ccc(O)nc1	Nc1ccc([O-])nc1	mol6371	Nc1ccc(O)nc1
3.77	IUPAC digitized pKa	1	0	Nc1ccc(O)[nH+]c1,[NH3+]c1ccc(O)nc1	Nc1ccc(O)nc1	mol6371	Nc1ccc(O)nc1
3.76999998092651	QSARToolbox	1	0	Nc1ccc(O)[nH+]c1,[NH3+]c1ccc(O)nc1	Nc1ccc(O)nc1	mol6371	Nc1ccc(O)nc1
-0.61	IUPAC digitized pKa	2	1	[NH3+]c1ccc(O)[nH+]c1	Nc1ccc(O)[nH+]c1,[NH3+]c1ccc(O)nc1	mol6371	Nc1ccc(O)nc1
-0.610000014305115	QSARToolbox	2	1	[NH3+]c1ccc(O)[nH+]c1	Nc1ccc(O)[nH+]c1,[NH3+]c1ccc(O)nc1	mol6371	Nc1ccc(O)nc1