Trade Names: | |
Synonyms: | |
Status: | Approved (1968) |
Entry Type: | Small molecule |
Molecule Category: | Salt |
UNII: | MUN5LYG46H |
Parent Compound: | FENTANYL |
InChI Key | IVLVTNPOHDFFCJ-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C28H36N2O8 |
Molecular Weight | 528.6 |
AlogP | 4.14 |
Hydrogen Bond Acceptor | 2.0 |
Hydrogen Bond Donor | 0.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 23.55 |
Molecular species | BASE |
Aromatic Rings | 2.0 |
Heavy Atoms | 25.0 |
Action | Mechanism of Action | Reference |
---|---|---|
AGONIST | Mu opioid receptor agonist | DailyMed |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Membrane receptor
Family A G protein-coupled receptor
Peptide receptor (family A GPCR)
Short peptide receptor (family A GPCR)
Opioid receptor
|
- | 2 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Chronic Pain | 3 | D059350 | ClinicalTrials |
Lung Diseases, Interstitial | 3 | D017563 | ClinicalTrials |
Dyspnea | 3 | D004417 | ClinicalTrials |
Low Back Pain | 3 | D017116 | ClinicalTrials |
Neuralgia | 3 | D009437 | ClinicalTrials |
Dyspnea | 3 | D004417 | ClinicalTrials |
Pulpitis | 2 | D011671 | ClinicalTrials |
Resources | Reference |
---|---|
ChEBI | 31602 |
ChEMBL | CHEMBL688 |
EPA CompTox | DTXSID80243933 |
FDA SRS | MUN5LYG46H |
Guide to Pharmacology | 1626 |
KEGG | D00320 |
PubChem | 13810 |
SureChEMBL | SCHEMBL40733 |
ZINC | ZINC02522669 |