compound 1 [PMID: 11425539]

Ligand id: 6542

Name: compound 1 [PMID: 11425539]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 40.62
Molecular weight 266.11
XLogP 5.12
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1,3-bis(phenylmethyl)-1,3-diazetidine-2,4-dione
Database Links
ChEMBL Ligand CHEMBL47394
PubChem CID 10038543
Search Google for chemical match using the InChIKey PGIXYPNBNAOYHW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PGIXYPNBNAOYHW
Search UniChem for chemical match using the InChIKey PGIXYPNBNAOYHW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PGIXYPNBNAOYHW
Comments
Cathepsin G inhibitor