Molecule ID: mol25938

SMILES: COc1cccc(Nc2nnn[nH]2)c1

InChI: InChI=1S/C8H9N5O/c1-14-7-4-2-3-6(5-7)9-8-10-12-13-11-8/h2-5H,1H3,(H2,9,10,11,12,13)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.80 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization