pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.0	OCHEM	0	-1	CC(C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccc(O)c1O	CC(C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccc([O-])c1O,CC(C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccc(O)c1[O-]	mol18102	CC(C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1nccc(O)c1O
