Molecule ID: mol34547

SMILES: c1ccc(-c2nnn(CCc3nnnn3Cc3nnn[nH]3)n2)cc1

InChI: InChI=1S/C12H12N12/c1-2-4-9(5-3-1)12-16-21-24(17-12)7-6-11-15-20-22-23(11)8-10-13-18-19-14-10/h1-5H,6-8H2,(H,13,14,18,19)

Experimental Macro pKa Values

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