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Chemistry

Mol. Mass

550.92

ALogP

9.63

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CCCCCCCCN=C1C=CN(CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2)C=C1
  • InChIKey: ZVXNYZWXUADSRV-UHFFFAOYSA-N
    InChI=1S/C36H62N4/c1-3-5-7-9-15-19-27-37-35-23-31-39(32-24-35)29-21-17-13-11-12-14-18-22-30-40-33-25-36(26-34-40)38-28-20-16-10-8-6-4-2/h23-26,31-34H,3-22,27-30H2,1-2H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1199480   ChEMBL

CHEMBL2106445   ChEMBL

CHEMBL61122   ChEMBL
octenidine

Octenidine dihydrochloride   Wikipedia

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