selisistat

Ligand id: 8100

Name: selisistat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 58.88
Molecular weight 248.07
XLogP 2.28
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
International Nonproprietary Names
INN number INN
9502 selisistat
Synonyms
EX 527 | EX-527 | EX527
Database Links
CAS Registry No. 49843-98-3
ChEMBL Ligand CHEMBL420311
PubChem CID 5113032
Search Google for chemical match using the InChIKey FUZYTVDVLBBXDL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone FUZYTVDVLBBXDL
Search PubMed clinical trials selisistat
Search PubMed titles selisistat
Search PubMed titles/abstracts selisistat
Search UniChem for chemical match using the InChIKey FUZYTVDVLBBXDL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone FUZYTVDVLBBXDL
Comments
Selisistat is an inhibitor of sirtuin 1 (SIRT1) catalytic activity [2]. SIRT1 is an enzyme which deacetylates the p53 tumor suppressor protein and may modulate p53-dependent functions such as DNA damage-induced cell death.
The SIRT histone deacetylases have been implicated in a wide range of cellular processes including stress resistance, metabolism, differentiation, and aging [1].