baclofen

Ligand id: 1084

Name: baclofen

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View more information in the IUPHAR Pharmacology Education Project: baclofen

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 63.32
Molecular weight 213.06
XLogP 1.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2007))
IUPAC Name
4-amino-3-(4-chlorophenyl)butanoic acid
International Nonproprietary Names
INN number INN
2956 baclofen
Synonyms
Baclon® | Kemstro® | Lioresal®
Database Links
BindingDB Ligand 24182
CAS Registry No. 1134-47-0
ChEBI CHEBI:2972
ChEMBL Ligand CHEMBL701
DrugBank Ligand DB00181
GtoPdb PubChem SID 135649976
PubChem CID 2284
Search Google for chemical match using the InChIKey KPYSYYIEGFHWSV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KPYSYYIEGFHWSV
Search PubMed clinical trials baclofen
Search PubMed titles baclofen
Search PubMed titles/abstracts baclofen
Search UniChem for chemical match using the InChIKey KPYSYYIEGFHWSV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KPYSYYIEGFHWSV
SynPHARM 2816 (in complex with GABAB receptor)
Wikipedia Baclofen
Comments
The approved drug baclofen is a racemic mixture of two enantiomers; (R)-baclofen and (S)-baclofen. We show the non-stereo structure to represent the mixture.