pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.24	AttenGpKa training set	1	0	COC(=O)CC12CC[NH+](CC1)CC2	COC(=O)CC12CCN(CC1)CC2	mol24598	COC(=O)CC12CCN(CC1)CC2