pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.31	IUPAC digitized pKa	1	0	CCOC(=O)[C@@H]([NH3+])Cc1ccc(OC)cc1	CCOC(=O)[C@@H](N)Cc1ccc(OC)cc1	mol5488	CCOC(=O)[C@@H](N)Cc1ccc(OC)cc1
7.30999994277954	QSARToolbox	1	0	CCOC(=O)[C@@H]([NH3+])Cc1ccc(OC)cc1	CCOC(=O)[C@@H](N)Cc1ccc(OC)cc1	mol5488	CCOC(=O)[C@@H](N)Cc1ccc(OC)cc1