Molecule ID: mol15797

SMILES: NC(=O)N/N=C/c1ncnc2nc[nH]c12

InChI: InChI=1S/C7H7N7O/c8-7(15)14-13-1-4-5-6(11-2-9-4)12-3-10-5/h1-3H,(H3,8,14,15)(H,9,10,11,12)/b13-1+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.10 Datawarrior 2 » 1
9.10 Datawarrior -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization