pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.24	OCHEM	1	0	CCOC(=O)c1cnc2oc(/C=N/N3C[C@@H](C[NH+]4CCOCC4)OC3=O)cc2c1O	CCOC(=O)c1cnc2oc(/C=N/N3C[C@@H](CN4CCOCC4)OC3=O)cc2c1O	mol31823	CCOC(=O)c1cnc2oc(/C=N/N3CC(CN4CCOCC4)OC3=O)cc2c1O