pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.97	OCHEM	0	-1	Cc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-]	Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1[N+](=O)[O-]	mol923	Cc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-]
2.97000002861023	QSARToolbox	0	-1	Cc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-]	Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1[N+](=O)[O-]	mol923	Cc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-]