pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.23	Baltruschat ChEMBL	1	0	CC[NH+](CC)CCN1C(=O)Nc2ccccc2[C@@H]1c1ccccc1	CCN(CC)CCN1C(=O)Nc2ccccc2[C@@H]1c1ccccc1	mol16159	CCN(CC)CCN1C(=O)Nc2ccccc2C1c1ccccc1
