pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.56	AttenGpKa training set	1	0	Cc1[nH+]nc(N)s1,Cc1nnc([NH3+])s1,Cc1n[nH+]c(N)s1	Cc1nnc(N)s1	mol25284	Cc1nnc(N)s1