pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.42	AttenGpKa training set	1	0	COc1ccc(-n2[nH+]ccc2N)cc1,COc1ccc(-n2nccc2[NH3+])cc1	COc1ccc(-n2nccc2N)cc1	mol25468	COc1ccc(-n2nccc2N)cc1