Molecule ID: mol10109

SMILES: Cn1cnc2ncc(=O)[nH]c2c1=O

InChI: InChI=1S/C7H6N4O2/c1-11-3-9-6-5(7(11)13)10-4(12)2-8-6/h2-3H,1H3,(H,10,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization