pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.43000030517578	QSARToolbox	0	-1	O=[N+]([O-])c1ccc(/C=N/O)c([N+](=O)[O-])c1	O=[N+]([O-])c1ccc(/C=N/[O-])c([N+](=O)[O-])c1	mol31621	O=[N+]([O-])c1ccc(/C=N/O)c([N+](=O)[O-])c1
9.43	AttenGpKa training set	0	-1	O=[N+]([O-])c1ccc(/C=N/O)c([N+](=O)[O-])c1	O=[N+]([O-])c1ccc(/C=N/[O-])c([N+](=O)[O-])c1	mol31621	O=[N+]([O-])c1ccc(/C=N/O)c([N+](=O)[O-])c1