pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.2	Baltruschat ChEMBL	0	-1	CC[NH+]1CCC[C@H]1CNC(=O)c1c([O-])c(Cl)cc(Cl)c1OC	CCN1CCC[C@H]1CNC(=O)c1c([O-])c(Cl)cc(Cl)c1OC	mol17507	CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC
