Molecule ID: mol34565

SMILES: c1ccc(CN2CCCN(Cc3ccccn3)Cc3cccc(n3)CN(Cc3ccccn3)CCC2)nc1

InChI: InChI=1S/C31H37N7/c1-4-15-32-27(10-1)22-36-18-8-20-37(23-28-11-2-5-16-33-28)25-30-13-7-14-31(35-30)26-38(21-9-19-36)24-29-12-3-6-17-34-29/h1-7,10-17H,8-9,18-26H2

Experimental Macro pKa Values

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