KB-141

Ligand id: 2638

Name: KB-141

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 66.76
Molecular weight 354.04
XLogP 4.33
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[3,5-dichloro-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]acetic acid
Synonyms
KB 141 | KB141
Database Links
BindingDB Ligand 18869
CAS Registry No. 219691-94-8 (source: Scifinder)
ChEMBL Ligand CHEMBL41036
DrugBank Ligand DB03176
NURSA Ligand 10.1621/89PLF199GV
PubChem CID 9863447
RCSB PDB Ligand IH5
Search Google for chemical match using the InChIKey OZYQIQVPUZANTM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone OZYQIQVPUZANTM
Search UniChem for chemical match using the InChIKey OZYQIQVPUZANTM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone OZYQIQVPUZANTM
SynPHARM 6263 (in complex with Thyroid hormone receptor-α)
6267 (in complex with Thyroid hormone receptor-β)