pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.6	Baltruschat ChEMBL	1	0	COc1ccc(OC(=O)NCCC[NH3+])cc1	COc1ccc(OC(=O)NCCCN)cc1	mol20747	COc1ccc(OC(=O)NCCCN)cc1