ragaglitazar

Ligand id: 2664

Name: ragaglitazar

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 68.23
Molecular weight 419.17
XLogP 5.73
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-2-ethoxy-3-[4-(2-phenoxazin-10-ylethoxy)phenyl]propanoic acid
International Nonproprietary Names
INN number INN
8110 ragaglitazar
Database Links
CAS Registry No. 222834-30-2 (source: Scifinder)
ChEMBL Ligand CHEMBL24038
PubChem CID 447458
RCSB PDB Ligand DRF
Search Google for chemical match using the InChIKey WMUIIGVAWPWQAW-DEOSSOPVSA-N
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Search UniChem for chemical match using the InChIKey WMUIIGVAWPWQAW-DEOSSOPVSA-N
Search UniChem for chemicals with the same backbone WMUIIGVAWPWQAW
SynPHARM 6339 (in complex with Peroxisome proliferator-activated receptor-γ)