Molecule ID: mol8250

SMILES: Cc1nc2nc(N)nc(O)c2n1C

InChI: InChI=1S/C7H9N5O/c1-3-9-5-4(12(3)2)6(13)11-7(8)10-5/h1-2H3,(H3,8,10,11,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization