pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.69999980926514	QSARToolbox	0	-1	N=C(Nc1ccc(Cl)cc1)N[N+](=O)[O-]	N=C([N-][N+](=O)[O-])Nc1ccc(Cl)cc1	mol28078	N=C(Nc1ccc(Cl)cc1)N[N+](=O)[O-]
9.7	AttenGpKa training set	0	-1	N=C(Nc1ccc(Cl)cc1)N[N+](=O)[O-]	N=C([N-][N+](=O)[O-])Nc1ccc(Cl)cc1	mol28078	N=C(Nc1ccc(Cl)cc1)N[N+](=O)[O-]