pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.92	AttenGpKa training set	1	0	Cc1ccccc1C[NH+]1CCN(CCO)CC1,Cc1ccccc1CN1CC[NH+](CCO)CC1	Cc1ccccc1CN1CCN(CCO)CC1	mol29632	Cc1ccccc1CN1CCN(CCO)CC1