pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.38000011444092	QSARToolbox	0	-1	COc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O	COc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[O-]	mol30676	COc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O