pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.96	IUPAC digitized pKa	1	0	CNc1ncnc(NC)c1[NH2+]C,CNc1nc[nH+]c(NC)c1NC,CNc1ncnc([NH2+]C)c1NC	CNc1ncnc(NC)c1NC	mol7538	CNc1ncnc(NC)c1NC
6.01	AttenGpKa training set	1	0	CNc1ncnc(NC)c1[NH2+]C,CNc1nc[nH+]c(NC)c1NC,CNc1ncnc([NH2+]C)c1NC	CNc1ncnc(NC)c1NC	mol7538	CNc1ncnc(NC)c1NC