Molecule ID: mol34588

SMILES: c1ccc2[nH]c(CN3CCNCCNCCNCC3)nc2c1

InChI: InChI=1S/C16H26N6/c1-2-4-15-14(3-1)20-16(21-15)13-22-11-9-18-7-5-17-6-8-19-10-12-22/h1-4,17-19H,5-13H2,(H,20,21)

Experimental Macro pKa Values

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