pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.6	IUPAC digitized pKa	0	-1	O=C(O)CCc1ccccc1F	O=C([O-])CCc1ccccc1F	mol10982	O=C(O)CCc1ccccc1F
4.59999990463257	QSARToolbox	0	-1	O=C(O)CCc1ccccc1F	O=C([O-])CCc1ccccc1F	mol10982	O=C(O)CCc1ccccc1F
4.61999988555908	QSARToolbox	0	-1	O=C(O)CCc1ccccc1F	O=C([O-])CCc1ccccc1F	mol10982	O=C(O)CCc1ccccc1F
4.61	AttenGpKa training set	0	-1	O=C(O)CCc1ccccc1F	O=C([O-])CCc1ccccc1F	mol10982	O=C(O)CCc1ccccc1F