pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.1599998474121	QSARToolbox	0	-1	CC1(C)OC(=O)[C@H]([C@@H](c2cccc(Cl)c2)N2CCCCC2)[C@@H](O)O1	CC1(C)OC(=O)[C@H]([C@@H](c2cccc(Cl)c2)N2CCCCC2)[C@@H]([O-])O1	mol34920	CC1(C)OC(=O)C(C(c2cccc(Cl)c2)N2CCCCC2)C(O)O1