pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.34	AttenGpKa training set	1	0	CCOc1cc(C)[nH+]n1-c1ccccc1	CCOc1cc(C)nn1-c1ccccc1	mol6895	CCOc1cc(C)nn1-c1ccccc1