Molecule ID: mol9637

SMILES: Cc1n[nH]c2ncnc(=O)c-2n1

InChI: InChI=1S/C6H5N5O/c1-3-9-4-5(11-10-3)7-2-8-6(4)12/h2H,1H3,(H,7,8,11,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.00 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization