Molecule ID: mol7665

SMILES: Cc1nc(N)n[nH]1

InChI: InChI=1S/C3H6N4/c1-2-5-3(4)7-6-2/h1H3,(H3,4,5,6,7)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.68 IUPAC digitized pKa 1 » 0
4.68 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization