sobetirome

Ligand Id: 2639
Ligand name sobetirome

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 66.76
Molecular weight 328.17
XLogP 5.56
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
2-[4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]-3,5-dimethylphenoxy]acetic acid
International Nonproprietary Names
INN number INN
9089 sobetirome
Synonyms
GC 1 compound
GC-1
QRX-431
Database Links
BindingDB Ligand 50115668
CAS Registry No. 211110-63-3 (source: Scifinder)
ChEMBL Ligand CHEMBL107400
DrugBank Ligand DB07425
NURSA Ligand 10.1621/VTWFVH57FB
PubChem CID 9862248
RCSB PDB Ligand B72
Search Google for chemical match using the InChIKey QNAZTOHXCZPOSA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QNAZTOHXCZPOSA
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