pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.11	Baltruschat ChEMBL	1	0	COc1ccccc1C(=O)N[C@@H]1CCC[C@@H]2CC[NH+](C)C[C@@H]21	COc1ccccc1C(=O)N[C@@H]1CCC[C@@H]2CCN(C)C[C@@H]21	mol20070	COc1ccccc1C(=O)N[C@@H]1CCC[C@@H]2CCN(C)C[C@@H]21