Molecule ID: mol8345

SMILES: C1=Nc2nn(Cc3ccccc3)nc2CN1

InChI: InChI=1S/C11H11N5/c1-2-4-9(5-3-1)7-16-14-10-6-12-8-13-11(10)15-16/h1-5,8H,6-7H2,(H,12,13,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization