givinostat

Ligand id: 7490

Name: givinostat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 90.9
Molecular weight 421.2
XLogP 5.34
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[6-(diethylaminomethyl)naphthalen-2-yl]methyl N-[4-(hydroxycarbamoyl)phenyl]carbamate
International Nonproprietary Names
INN number INN
9132 givinostat
Synonyms
gavinostat | ITF-2357 | ITF2357
Database Links
CAS Registry No. 497833-27-9
ChEMBL Ligand CHEMBL1213492
PubChem CID 9804992
Search Google for chemical match using the InChIKey YALNUENQHAQXEA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YALNUENQHAQXEA
Search PubMed clinical trials givinostat
Search PubMed titles givinostat
Search PubMed titles/abstracts givinostat
Search UniChem for chemical match using the InChIKey YALNUENQHAQXEA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YALNUENQHAQXEA
Wikipedia Givinostat
Comments
Givinostat is a pan-histone deacetylase (HDAC) inhibitor [2]. The clinically used formulation contains the hydrochloride (PubChem CID 52914048).