pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.07	OCHEM	0	-1	[NH3+][C@@H](Cc1cc(O)no1)C(=O)[O-]	N[C@@H](Cc1cc(O)no1)C(=O)[O-],[NH3+][C@@H](Cc1cc([O-])no1)C(=O)[O-]	mol32190	NC(Cc1cc(O)no1)C(=O)O
1.9	OCHEM	1	0	[NH3+][C@@H](Cc1cc(O)no1)C(=O)O	[NH3+][C@@H](Cc1cc(O)no1)C(=O)[O-]	mol32190	NC(Cc1cc(O)no1)C(=O)O
8.81	OCHEM	-1	-2	N[C@@H](Cc1cc(O)no1)C(=O)[O-],[NH3+][C@@H](Cc1cc([O-])no1)C(=O)[O-]	N[C@@H](Cc1cc([O-])no1)C(=O)[O-]	mol32190	NC(Cc1cc(O)no1)C(=O)O