pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.19	Baltruschat ChEMBL	1	0	COc1ccc(C(=O)N[C@@H]2CCC[C@@H]3CC[NH+](C)C[C@@H]32)cc1	COc1ccc(C(=O)N[C@@H]2CCC[C@@H]3CCN(C)C[C@@H]32)cc1	mol20072	COc1ccc(C(=O)N[C@@H]2CCC[C@@H]3CCN(C)C[C@@H]32)cc1