isatin sulfonamide 34 [PMID: 11384246]

Ligand id: 6515

Name: isatin sulfonamide 34 [PMID: 11384246]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 92.37
Molecular weight 476.14
XLogP 5.67
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(phenylmethyl)indole-2,3-dione
Database Links
ChEMBL Ligand CHEMBL439753
PubChem CID 9847835
Search Google for chemical match using the InChIKey PKOUAUWPBMZQCH-FQEVSTJZSA-N
Search Google for chemicals with the same backbone PKOUAUWPBMZQCH
Search UniChem for chemical match using the InChIKey PKOUAUWPBMZQCH-FQEVSTJZSA-N
Search UniChem for chemicals with the same backbone PKOUAUWPBMZQCH
Comments
Caspase 7 inhibitor.