Molecule ID: mol38105

SMILES: O=C1C2=C(CCCC2)C(=O)N1CCN1CCN(c2cccc3c2OCCO3)CC1

InChI: InChI=1S/C22H27N3O4/c26-21-16-4-1-2-5-17(16)22(27)25(21)13-10-23-8-11-24(12-9-23)18-6-3-7-19-20(18)29-15-14-28-19/h3,6-7H,1-2,4-5,8-15H2

Experimental Macro pKa Values

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