compound (R)-26 [PMID: 22686657]

Ligand id: 6535

Name: compound (R)-26 [PMID: 22686657]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 118.96
Molecular weight 380.15
XLogP 2.03
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(1R)-1-(N'-cyano-N,N'-dimethylhydrazinecarbonyl)-2-(2-methylpropanesulfonyl)ethyl]benzamide
Database Links
ChEMBL Ligand CHEMBL2153161
PubChem CID 60148519
Search Google for chemical match using the InChIKey UGAZRSHSXNNYTK-HNNXBMFYSA-N
Search Google for chemicals with the same backbone UGAZRSHSXNNYTK
Search UniChem for chemical match using the InChIKey UGAZRSHSXNNYTK-HNNXBMFYSA-N
Search UniChem for chemicals with the same backbone UGAZRSHSXNNYTK
Comments
Potent selctive inhibitor of cathepsin S