Molecule ID: mol35018

SMILES: CC(C)(C)C/C(=N\C#N)Nc1cccnc1

InChI: InChI=1S/C12H16N4/c1-12(2,3)7-11(15-9-13)16-10-5-4-6-14-8-10/h4-6,8H,7H2,1-3H3,(H,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.23 QSARToolbox 2 » 1
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Charge States and Microspecies Visualization