Molecule ID: mol26256

SMILES: CC1=Nc2cnc(O)nc2NC1(C)O

InChI: InChI=1S/C8H10N4O2/c1-4-8(2,14)12-6-5(10-4)3-9-7(13)11-6/h3,14H,1-2H3,(H2,9,11,12,13)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.15 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization