pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.05	Caine	0	-1	COCCOCCc1nc(C(F)(F)F)ccc1C(=O)[C@@H]1C(=O)[C@@H]2CC[C@@H](C2)C1=O	COCCOCCc1nc(C(F)(F)F)ccc1C(=O)[C-]1C(=O)[C@@H]2CC[C@@H](C2)C1=O,COCCOCCc1nc(C(F)(F)F)ccc1C(=O)[C@@H]1C(=O)[C-]2CC[C@@H](C2)C1=O	mol2698	COCCOCCc1nc(C(F)(F)F)ccc1C(=O)C1C(=O)C2CCC(C2)C1=O