compound 1e [PMID: 27285276]

Ligand id: 9550

Name: compound 1e [PMID: 27285276]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 41.46
Molecular weight 258.06
XLogP 5.85
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(4-chlorophenyl)methylideneamino]benzamide
Database Links
ChEMBL Ligand CHEMBL2235152
GtoPdb PubChem SID 336446936
PubChem CID 6861534
Search Google for chemical match using the InChIKey YJGPDMQKIPQVLX-MHWRWJLKSA-N
Search Google for chemicals with the same backbone YJGPDMQKIPQVLX
Search UniChem for chemical match using the InChIKey YJGPDMQKIPQVLX-MHWRWJLKSA-N
Search UniChem for chemicals with the same backbone YJGPDMQKIPQVLX
Comments
Compound 1e [PMID: 27285276] is a cathepsin H inhibitor [1].