diperodon hydrochloride Report issue

Small molecule Experimental
ChEMBL Drug Central PubChem

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Chemistry

Mol. Mass

397.4675

ALogP

4.34

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=C(NC1=CC=CC=C1)OCC(CN2CCCCC2)OC(=O)NC3=CC=CC=C3
  • InChIKey: YUGZHQHSNYIFLG-UHFFFAOYSA-N
    1S/C22H27N3O4/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27)
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2109119   ChEMBL
diperodon hydrochloride

CHEMBL338667   ChEMBL
diperodon

UIN4PYP84R   NCATS
diperodon anhydrous *

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