(-)-baclofen

Ligand id: 1064

Name: (-)-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
IUPAC Name
(3R)-4-amino-3-(4-chlorophenyl)butanoic acid
International Nonproprietary Names
INN number INN
9360 arbaclofen
2956 baclofen
Synonyms
(R)-(-)-baclofen | p-chlorophenyl GABA
Database Links
BindingDB Ligand 50032964
CAS Registry No. 69308-37-8 (source: Scifinder)
ChEMBL Ligand CHEMBL301742
DrugBank Ligand DB00181
PubChem CID 44602
RCSB PDB Ligand 2C0
Search Google for chemical match using the InChIKey KPYSYYIEGFHWSV-QMMMGPOBSA-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-QMMMGPOBSA-N
Search UniChem for chemicals with the same backbone KPYSYYIEGFHWSV
Comments
(-)-baclofen is a component of the approved drug baclofen, a racemic mixture of two enantiomers, as well as being assigned the INN arbaclofen in its own right.