pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.73000001907349	QSARToolbox	1	0	[NH3+]Cc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]	NCc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]	mol24301	NCc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]
7.73	AttenGpKa training set	1	0	[NH3+]Cc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]	NCc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]	mol24301	NCc1cc([N+](=O)[O-])ccc1[N+](=O)[O-]