Molecule ID: mol34859

SMILES: COc1ccccc1C(=O)Nc1nnn[nH]1

InChI: InChI=1S/C9H9N5O2/c1-16-7-5-3-2-4-6(7)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.09 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization