buprenorphine

Ligand id: 1670

Name: buprenorphine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 62.16
Molecular weight 467.3
XLogP 3.87
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Approved drug? Yes (source: FDA (1981))
IUPAC Name
(1S,2R,6S,14R,15R,16R)-3-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-15-methoxy-13-oxa-3-azahexacyclo[13.2.2.1^{2,8}.0^{1,6}.0^{6,14}.0^{7,12}]icosa-7(12),8,10-trien-11-ol
International Nonproprietary Names
INN number INN
3403 buprenorphine
Synonyms
Buprenex®
Temgesic®
Database Links
CAS Registry No. 52485-79-7 (source: Scifinder)
ChEBI CHEBI:3216
ChEMBL Ligand CHEMBL560511
DrugBank Ligand DB00921
PharmGKB Drug PA448685
PubChem CID 644073
Search Google for chemical match using the InChIKey RMRJXGBAOAMLHD-IHFGGWKQSA-N
Search Google for chemicals with the same backbone RMRJXGBAOAMLHD
Search PubMed clinical trials buprenorphine
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Wikipedia Buprenorphine
Comments
Buprenorphine is a more potent and longer lasting analgesic than morphine.