pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.07	AttenGpKa training set	1	0	O[N+]12CCN(CC1)CC2,[O-][N+]12CC[NH+](CC1)CC2	[O-][N+]12CCN(CC1)CC2	mol24512	O[N+]12CCN(CC1)CC2