pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.73	OCHEM	1	0	COC(=O)/C=C(\O)c1ccc[n+](C)c1	COC(=O)/C=C(\[O-])c1ccc[n+](C)c1	mol31209	COC(=O)/C=C(\O)c1ccc[n+](C)c1
5.73000001907349	QSARToolbox	1	0	COC(=O)/C=C(\O)c1ccc[n+](C)c1	COC(=O)/C=C(\[O-])c1ccc[n+](C)c1	mol31209	COC(=O)/C=C(\O)c1ccc[n+](C)c1