pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.80999994277954	QSARToolbox	-1	-2	O=C([O-])C(=C1CCCCC1)C(C(=O)O)=C(c1ccccc1)c1ccccc1,O=C([O-])C(C(C(=O)O)=C1CCCCC1)=C(c1ccccc1)c1ccccc1	O=C([O-])C(=C1CCCCC1)C(C(=O)[O-])=C(c1ccccc1)c1ccccc1	mol35960	O=C(O)C(=C1CCCCC1)C(C(=O)O)=C(c1ccccc1)c1ccccc1