pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.47	Datawarrior	0	-1	O=C1CNC(=O)[C@H](Cc2ccc(O)cc2)N1	O=C1CNC(=O)[C@H](Cc2ccc([O-])cc2)N1	mol14553	O=C1CNC(=O)C(Cc2ccc(O)cc2)N1
9.4700003	OCHEM	0	-1	O=C1CNC(=O)[C@H](Cc2ccc(O)cc2)N1	O=C1CNC(=O)[C@H](Cc2ccc([O-])cc2)N1	mol14553	O=C1CNC(=O)C(Cc2ccc(O)cc2)N1