Molecule ID: mol37615

SMILES: CN1CCN([C@H]2C[C@@H]3[C@H](C2)[C@@H]3N2CCN([C@@H]3[C@@H]4C[C@H](N5CCN(C)CC5)C[C@@H]43)CC2)CC1

InChI: InChI=1S/C26H46N6/c1-27-3-7-29(8-4-27)19-15-21-22(16-19)25(21)31-11-13-32(14-12-31)26-23-17-20(18-24(23)26)30-9-5-28(2)6-10-30/h19-26H,3-18H2,1-2H3/t19-,20-,21+,22-,23+,24-,25+,26+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.38 QSARToolbox 4 » 3
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Charge States and Microspecies Visualization