pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.8899998664856	QSARToolbox	0	-1	CC(=NO)C(=NO)C(=O)Nc1ccc([N+](=O)[O-])cc1	CC(=N[O-])C(=NO)C(=O)Nc1ccc([N+](=O)[O-])cc1,CC(=NO)C(=N[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1	mol34673	CC(=NO)C(=NO)C(=O)Nc1ccc([N+](=O)[O-])cc1