ibipinabant

Ligand id: 9234

Name: ibipinabant

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 82.51
Molecular weight 486.07
XLogP 7.59
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(4S)-3-(4-chlorophenyl)-N-(4-chlorophenyl)sulfonyl-N'-methyl-4-phenyl-4,5-dihydropyrazole-1-carboximidamide
International Nonproprietary Names
INN number INN
8992 ibipinabant
Synonyms
BMS-646256 | SLV319 [1]
Database Links
BindingDB Ligand 50230537
CAS Registry No. 464213-10-3 (source: WHO INN record)
ChEMBL Ligand CHEMBL412262
PubChem CID 9826744
Search Google for chemical match using the InChIKey AXJQVVLKUYCICH-OAQYLSRUSA-N
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Search UniChem for chemical match using the InChIKey AXJQVVLKUYCICH-OAQYLSRUSA-N
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Comments
Ibipinabant is a selective cannabinoid CB1 receptor antagonist [1], investigated for its clinical potential as an anti-obesity drug.