pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.5	Datawarrior	1	0	CCc1[nH]cc(C)[nH+]1	CCc1nc(C)c[nH]1	mol12372	CCc1nc(C)c[nH]1
8.68	AttenGpKa training set	1	0	CCc1[nH]cc(C)[nH+]1	CCc1nc(C)c[nH]1	mol12372	CCc1nc(C)c[nH]1