pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.0	AttenGpKa training set	1	0	N#Cc1nn(-c2ccncc2)[nH+]c1N,N#Cc1nn(-c2cc[nH+]cc2)nc1N,N#Cc1[nH+]n(-c2ccncc2)nc1N,N#Cc1nn(-c2ccncc2)nc1[NH3+]	N#Cc1nn(-c2ccncc2)nc1N	mol25459	N#Cc1nn(-c2ccncc2)nc1N