pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.5	AttenGpKa training set	1	0	CCN(C)c1ccc([NH+]2CCOCC2)cc1,CC[NH+](C)c1ccc(N2CCOCC2)cc1	CCN(C)c1ccc(N2CCOCC2)cc1	mol23944	CCN(C)c1ccc(N2CCOCC2)cc1