Molecule ID: mol38466

SMILES: O=C1CC2(CCCC2)CC(=O)N1CCN1CCN(c2cccc3c2OCCO3)CC1

InChI: InChI=1S/C23H31N3O4/c27-20-16-23(6-1-2-7-23)17-21(28)26(20)13-10-24-8-11-25(12-9-24)18-4-3-5-19-22(18)30-15-14-29-19/h3-5H,1-2,6-17H2

Experimental Macro pKa Values

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