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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1213351
CHEMBL1213351
Compound Name PROPOXYPHENE
ChEMBL Synonyms Prophene 65 | Kesso-Gesic | Darvon-N | Dolene | Darvon | Propoxyphene | Levopropoxyphene | Propoxyphene HCl | Dextropropoxyphene | Propoxyphene napsylate | Dextro Propoxyphene HCl | Levopropoxyphene napsylate | Dextropropoxiphene Chloride | Propoxyphene Hydrochloride 65 | Levopropoxyphene napsylate anhydrous | Levopropoxyphene napsylate, anhydrous
Max Phase 4 (Approved)
Trade Names Darvon | Dolene | Darvon-N | Kesso-Gesic | Prophene 65 | Propoxyphene HCl | Propoxyphene Hydrochloride 65
Molecular Formula C22H29NO2

Additional synonyms for CHEMBL1213351 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCC(=O)O[C@@](Cc1ccccc1)([C@H](C)CN(C)C)c2ccccc2
Standard InChI InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10- ...
Download InChI
Standard InChI Key XLMALTXPSGQGBX-GCJKJVERSA-N

Mechanism of Action

Mechanism of Action ChEMBL Target References
Mu opioid receptor agonist Mu opioid receptor DailyMed PubMed

Molecule Features

CHEMBL1213351 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Y Parenteral:N Topical:N Black Box:Y Availability Type:Prescription-only

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 2 structural alerts for CHEMBL1213351. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1213351

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
339.5 339.2198 4.71 9 29.54 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 0 0 3 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 9.2 4.1 2.32 2 25 0.62

Compound Cross References

ATC N - NERVOUS SYSTEM
N02 - ANALGESICS
N02A - OPIOIDS
N02AC - Diphenylpropylamine derivatives
N02AC04 - dextropropoxyphene

ChemSpider ChemSpider:XLMALTXPSGQGBX-GCJKJVERSA-N
DailyMed propoxyphene hydrochloride propoxyphene napsylate
Wikipedia Dextropropoxyphene Levopropoxyphene

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1213351



ACToR 469-62-5 21086-94-2
BindingDB 82269
ChEBI 51173
DrugBank DB06793 DB00647
FDA SRS S2F83W92TK
Guide to Pharmacology 7593
IBM Patent System EB4E6853BF02F5362CF35B5494DBECA8
Nikkaji J5.928E
PubChem 10100
PubChem: Thomson Pharma 15025964
SureChEMBL SCHEMBL25405

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/XLMALTXPSGQGBX-GCJKJVERSA-N spacer
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