pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1500001	OCHEM	1	0	CC(C)(C)[C@@]1(O)CC[NH+]2C[C@@H]3c4ccccc4CCc4cccc(c43)[C@@H]2C1	CC(C)(C)[C@@]1(O)CCN2C[C@@H]3c4ccccc4CCc4cccc(c43)[C@@H]2C1	mol32705	CC(C)(C)C1(O)CCN2CC3c4ccccc4CCc4cccc(c43)C2C1