Molecule ID: mol8131

SMILES: COc1cnc2nc(N)nc(N)c2n1

InChI: InChI=1S/C7H8N6O/c1-14-3-2-10-6-4(11-3)5(8)12-7(9)13-6/h2H,1H3,(H4,8,9,10,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization