Molecule ID: mol35908

SMILES: CCOc1ccc(Nc2nnn[nH]2)cc1

InChI: InChI=1S/C9H11N5O/c1-2-15-8-5-3-7(4-6-8)10-9-11-13-14-12-9/h3-6H,2H2,1H3,(H2,10,11,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization