Molecule ID: mol9411

SMILES: CONC1NC(=O)Nc2nn[nH]c21

InChI: InChI=1S/C5H8N6O2/c1-13-10-4-2-3(9-11-8-2)6-5(12)7-4/h4,10H,1H3,(H3,6,7,8,9,11,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.45 IUPAC digitized pKa 2 » 1
6.48 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization