Molecule ID: mol10215

SMILES: NC(=O)C(C(N)=O)C1NC(=O)Nc2nn[nH]c21

InChI: InChI=1S/C7H9N7O3/c8-4(15)1(5(9)16)2-3-6(13-14-12-3)11-7(17)10-2/h1-2H,(H2,8,15)(H2,9,16)(H3,10,11,12,13,14,17)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization