pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.85	Organic Oxygen Acids and Nitrogen Bases	0	-1	O=C(O)c1c(F)cccc1F	O=C([O-])c1c(F)cccc1F	mol21738	O=C(O)c1c(F)cccc1F
2.84999990463257	QSARToolbox	0	-1	O=C(O)c1c(F)cccc1F	O=C([O-])c1c(F)cccc1F	mol21738	O=C(O)c1c(F)cccc1F
2.26999998092651	QSARToolbox	0	-1	O=C(O)c1c(F)cccc1F	O=C([O-])c1c(F)cccc1F	mol21738	O=C(O)c1c(F)cccc1F
2.27	AttenGpKa training set	0	-1	O=C(O)c1c(F)cccc1F	O=C([O-])c1c(F)cccc1F	mol21738	O=C(O)c1c(F)cccc1F