3M-002

Ligand id: 9270

Name: 3M-002

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 80.04
Molecular weight 243.08
XLogP 3.27
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
Synonyms
CL-075 | CL075
Database Links
ChEMBL Ligand CHEMBL512901
PubChem CID 10198719
RCSB PDB Ligand L07
Search Google for chemical match using the InChIKey NFYMGJSUKCDVJR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NFYMGJSUKCDVJR
Search UniChem for chemical match using the InChIKey NFYMGJSUKCDVJR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NFYMGJSUKCDVJR
Comments
3M-002 is reported as a selective Toll-like receptor 8 agonist, which promotes TNF-α and IL-12 production from human PBMCs [1].