4-CMTB

Ligand id: 5500

Name: 4-CMTB

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 70.23
Molecular weight 294.06
XLogP 4.04
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-(4-chlorophenyl)-3-methyl-N-(1,3-thiazol-2-yl)butanamide
Comments
4-CMTB is a synthetic FFA2 allosteric modulator [1]. It exhibits allosteric cooperativity with the FFA2 agonist propionate (C3).
Database Links
ChEMBL Ligand CHEMBL610463
GtoPdb PubChem SID 178102146
PubChem CID 4307629
Search Google for chemical match using the InChIKey AZYDQCGCBQYFSE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AZYDQCGCBQYFSE
Search UniChem for chemical match using the InChIKey AZYDQCGCBQYFSE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AZYDQCGCBQYFSE

Product suppliers

Tocris
4-CMTB
Cat. No. 4642