pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.7	Datawarrior	0	-1	O=C(O)C[C@@H](c1ccccc1)c1ccccc1Cl	O=C([O-])C[C@@H](c1ccccc1)c1ccccc1Cl	mol14899	O=C(O)CC(c1ccccc1)c1ccccc1Cl
4.6999998	OCHEM	0	-1	O=C(O)C[C@@H](c1ccccc1)c1ccccc1Cl	O=C([O-])C[C@@H](c1ccccc1)c1ccccc1Cl	mol14899	O=C(O)CC(c1ccccc1)c1ccccc1Cl
4.69999980926514	QSARToolbox	0	-1	O=C(O)C[C@@H](c1ccccc1)c1ccccc1Cl	O=C([O-])C[C@@H](c1ccccc1)c1ccccc1Cl	mol14899	O=C(O)CC(c1ccccc1)c1ccccc1Cl