pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.7	Baltruschat ChEMBL	0	-1	CC(C)(Oc1cc2c(c(Cl)c1Cl)C(=O)[C@@](C)(C1CCCC1)C2)C(=O)O	CC(C)(Oc1cc2c(c(Cl)c1Cl)C(=O)[C@@](C)(C1CCCC1)C2)C(=O)[O-]	mol18220	CC(C)(Oc1cc2c(c(Cl)c1Cl)C(=O)C(C)(C1CCCC1)C2)C(=O)O
