pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.91	AttenGpKa training set	0	-1	O=c1c(O)c(CCCCCO)oc2ccccc12	O=c1c([O-])c(CCCCCO)oc2ccccc12	mol29657	O=c1c(O)c(CCCCCO)oc2ccccc12