pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.8	Baltruschat ChEMBL	1	0	CC1CCN(C(=O)c2ccc3cc(OCCC[NH+]4CCOCC4)ccc3c2)CC1	CC1CCN(C(=O)c2ccc3cc(OCCCN4CCOCC4)ccc3c2)CC1	mol17612	CC1CCN(C(=O)c2ccc3cc(OCCCN4CCOCC4)ccc3c2)CC1