compound 8 [PMID: 20598884]

Ligand id: 6436

Name: compound 8 [PMID: 20598884]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 94.02
Molecular weight 261.04
XLogP 2.39
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-cyano-5-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
Database Links
ChEMBL Ligand CHEMBL1209201
PubChem CID 46911384
Search Google for chemical match using the InChIKey KTQZJPKEGPXLRL-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey KTQZJPKEGPXLRL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KTQZJPKEGPXLRL