pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.85999989509583	QSARToolbox	0	-1	O=C(O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1	O=C([O-])c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1	mol34447	O=C(O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1