pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.19999980926514	QSARToolbox	0	-1	O=C(NO)c1ccccc1[N+](=O)[O-]	O=C(N[O-])c1ccccc1[N+](=O)[O-]	mol10118	O=C(NO)c1ccccc1[N+](=O)[O-]
8.2	AttenGpKa training set	0	-1	O=C(NO)c1ccccc1[N+](=O)[O-]	O=C(N[O-])c1ccccc1[N+](=O)[O-]	mol10118	O=C(NO)c1ccccc1[N+](=O)[O-]