nalmefene   Click here for help

GtoPdb Ligand ID: 1628

Synonyms: JF-1 | nalmetrene | Opvee® (nalmefene hydrochloride nasal spray) | ORF-11676 | Revex® (nalmefene hydrochloride) | Selincro®
Approved drug
nalmefene is an approved drug (EMA (2013), FDA (2023))
Compound class: Synthetic organic
Comment: Nalmefene is an opioid receptor antagonist.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 52.93
Molecular weight 339.18
XLogP 1.25
No. Lipinski's rules broken 0
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Canonical SMILES C=C1CCC2(C34C1Oc1c4c(CC2N(CC3)CC2CC2)ccc1O)O
Isomeric SMILES C=C1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)CC2CC2)ccc1O)O
InChI InChI=1S/C21H25NO3/c1-12-6-7-21(24)16-10-14-4-5-15(23)18-17(14)20(21,19(12)25-18)8-9-22(16)11-13-2-3-13/h4-5,13,16,19,23-24H,1-3,6-11H2/t16-,19+,20+,21-/m1/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (EMA (2013), FDA (2023))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
5189 nalmefene
Synonyms Click here for help
JF-1 | nalmetrene | Opvee® (nalmefene hydrochloride nasal spray) | ORF-11676 | Revex® (nalmefene hydrochloride) | Selincro®
Database Links Click here for help
Specialist databases
GPCRdb Ligand nalmefene
Other databases
CAS Registry No. 55096-26-9 (source: Scifinder)
DrugCentral Ligand 1876
GtoPdb PubChem SID 135650681
PubChem CID 5284594
Search Google for chemical match using the InChIKey WJBLNOPPDWQMCH-MBPVOVBZSA-N
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Search PubMed clinical trials nalmefene
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UniChem Compound Search for chemical match using the InChIKey WJBLNOPPDWQMCH-MBPVOVBZSA-N
UniChem Connectivity Search for chemical match using the InChIKey WJBLNOPPDWQMCH-MBPVOVBZSA-N
Wikipedia Nalmefene