Molecule ID: mol7415

SMILES: CN(C)c1ccc(-c2cnc(=N)n(C)c2)cc1

InChI: InChI=1S/C13H16N4/c1-16(2)12-6-4-10(5-7-12)11-8-15-13(14)17(3)9-11/h4-9,14H,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.19 IUPAC digitized pKa 2 » 1
11.26 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization