Molecule ID: mol26235

SMILES: CC1(O)C=Nc2cnc(O)nc2N1

InChI: InChI=1S/C7H8N4O2/c1-7(13)3-9-4-2-8-6(12)10-5(4)11-7/h2-3,13H,1H3,(H2,8,10,11,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.85 AttenGpKa training set -1 » -2
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Charge States and Microspecies Visualization