pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Datawarrior	0	-1	Cc1cc([N+](=O)[O-])ccc1O	Cc1cc([N+](=O)[O-])ccc1[O-]	mol14267	Cc1cc([N+](=O)[O-])ccc1O
7.2	OCHEM	0	-1	Cc1cc([N+](=O)[O-])ccc1O	Cc1cc([N+](=O)[O-])ccc1[O-]	mol14267	Cc1cc([N+](=O)[O-])ccc1O
7.0999999	OCHEM	0	-1	Cc1cc([N+](=O)[O-])ccc1O	Cc1cc([N+](=O)[O-])ccc1[O-]	mol14267	Cc1cc([N+](=O)[O-])ccc1O
7.09999990463257	QSARToolbox	0	-1	Cc1cc([N+](=O)[O-])ccc1O	Cc1cc([N+](=O)[O-])ccc1[O-]	mol14267	Cc1cc([N+](=O)[O-])ccc1O