Molecule ID: mol34551

SMILES: c1ccc(-c2nnn(Cc3nnn(Cc4nnn[nH]4)n3)n2)cc1

InChI: InChI=1S/C11H10N12/c1-2-4-8(5-3-1)11-15-21-23(17-11)7-10-14-20-22(16-10)6-9-12-18-19-13-9/h1-5H,6-7H2,(H,12,13,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.93 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization