Molecule ID: mol9001

SMILES: O=c1nc[nH][nH]c1=O

InChI: InChI=1S/C3H3N3O2/c7-2-3(8)6-5-1-4-2/h1H,(H,6,8)(H,4,5,7)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization