pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.35999989509583	QSARToolbox	1	0	O=C1C[NH+]=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1C[C@H](O)CO	O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1C[C@H](O)CO	mol38420	O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1CC(O)CO