pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.4	AttenGpKa training set	0	-1	N#Cc1nc(-n2c(N)nc(C#N)c2C#N)[nH]c1C#N	N#Cc1nc(-n2c(N)nc(C#N)c2C#N)[n-]c1C#N	mol25576	N#Cc1nc(-n2c(N)nc(C#N)c2C#N)[nH]c1C#N