pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.89	IUPAC digitized pKa	1	0	CNc1nc(C)[nH+]c(NC)c1N,CNc1nc(C)nc([NH2+]C)c1N,CNc1nc(C)nc(NC)c1[NH3+]	CNc1nc(C)nc(NC)c1N	mol7095	CNc1nc(C)nc(NC)c1N
6.92	AttenGpKa training set	1	0	CNc1nc(C)[nH+]c(NC)c1N,CNc1nc(C)nc([NH2+]C)c1N,CNc1nc(C)nc(NC)c1[NH3+]	CNc1nc(C)nc(NC)c1N	mol7095	CNc1nc(C)nc(NC)c1N