pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.75	Datawarrior	1	0	COc1c(C)[nH+]cc(CO)c1C=O	COc1c(C)ncc(CO)c1C=O	mol13961	COc1c(C)ncc(CO)c1C=O