Molecule ID: mol35659

SMILES: CCN(CCN)c1ccc(Cc2ccc(N(CC)CCN)cc2)cc1

InChI: InChI=1S/C21H32N4/c1-3-24(15-13-22)20-9-5-18(6-10-20)17-19-7-11-21(12-8-19)25(4-2)16-14-23/h5-12H,3-4,13-17,22-23H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization