pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.47000026702881	QSARToolbox	0	-1	O=C1CNC(=O)[C@H](Cc2ccc(O)cc2)N1	O=C1CNC(=O)[C@H](Cc2ccc([O-])cc2)N1,O=C1C[N-]C(=O)[C@H](Cc2ccc(O)cc2)N1	mol37512	O=C1CNC(=O)[C@H](Cc2ccc(O)cc2)N1