pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.23000001907349	QSARToolbox	0	-1	O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1Cl	O=[N+]([O-])c1ccc([O-])c([N+](=O)[O-])c1Cl	mol30686	O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1Cl
3.23	AttenGpKa training set	0	-1	O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1Cl	O=[N+]([O-])c1ccc([O-])c([N+](=O)[O-])c1Cl	mol30686	O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1Cl