rosiglitazone

Ligand Id: 1056
Ligand name rosiglitazone

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 96.83
Molecular weight 357.11
XLogP 2.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
Approved drug? Yes (source: FDA (1999))
IUPAC Name
5-[[4-[2-(methyl-pyridin-2-ylamino)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
International Nonproprietary Names
INN number INN
7662 rosiglitazone
Synonyms
Avandia®
rosiglizole
Database Links
BindingDB Ligand 28681
CAS Registry No. 122320-73-4 (source: ChEBI)
ChEBI CHEBI:50122
ChEMBL Ligand CHEMBL121
DrugBank Ligand DB00412
Human Metabolome Database HMDB05031
NURSA Ligand 10.1621/M7WK877IB8
PharmGKB Drug PA451283
PubChem CID 77999
RCSB PDB Ligand BRL
Search Google for chemical match using the InChIKey YASAKCUCGLMORW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YASAKCUCGLMORW
Search PubMed clinical trials rosiglitazone
Search PubMed titles rosiglitazone
Search PubMed titles/abstracts rosiglitazone
Wikipedia Rosiglitazone
Comments
Marketed formulations may contain rosiglitazone maleate (PubChem CID 5281055).