pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.71	OCHEM	0	-1	O=C(O)C=Cc1cccc(Cl)c1	O=C([O-])C=Cc1cccc(Cl)c1	mol32478	O=C(O)C=Cc1cccc(Cl)c1
4.29	OCHEM	0	-1	O=C(O)C=Cc1cccc(Cl)c1	O=C([O-])C=Cc1cccc(Cl)c1	mol32478	O=C(O)C=Cc1cccc(Cl)c1
4.28999996185303	QSARToolbox	0	-1	O=C(O)C=Cc1cccc(Cl)c1	O=C([O-])C=Cc1cccc(Cl)c1	mol32478	O=C(O)C=Cc1cccc(Cl)c1
