Molecule ID: mol26274

SMILES: CC1=Nc2c(C)nc(O)nc2NC1(C)O

InChI: InChI=1S/C9H12N4O2/c1-4-6-7(12-8(14)10-4)13-9(3,15)5(2)11-6/h15H,1-3H3,(H2,10,12,13,14)

Experimental Macro pKa Values

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