cipemastat

Ligand id: 6466

Name: cipemastat

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 110.26
Molecular weight 436.27
XLogP 1.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Ligand Activity Visualisation Charts

These are box plot that provide a unique visualisation, summarising all the activity data for a ligand taken from ChEMBL and GtoPdb across multiple targets and species. Click on a plot to see the median, interquartile range, low and high data points. A value of zero indicates that no data are available. A separate chart is created for each target, and where possible the algorithm tries to merge ChEMBL and GtoPdb targets by matching them on name and UniProt accession, for each available species. However, please note that inconsistency in naming of targets may lead to data for the same target being reported across multiple charts.

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View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Classification
Compound class Synthetic organic
IUPAC Name
(2R,3R)-3-(cyclopentylmethyl)-N-hydroxy-4-oxo-4-piperidin-1-yl-2-[(3,4,4-trimethyl-2,5-dioxoimidazolidin-1-yl)methyl]butanamide
International Nonproprietary Names
INN number INN
7862 cipemastat
Synonyms
Ro 28-2653
Comments
Cipemastat is a selective matrix metalloproteinase-1 inhibitor.
Database Links
CAS Registry No. 9824350
ChEMBL Ligand CHEMBL115653
GtoPdb PubChem SID 178103080
PubChem CID 9824350
Search Google for chemical match using the InChIKey GFUITADOEPNRML-SJORKVTESA-N
Search Google for chemicals with the same backbone GFUITADOEPNRML
Search PubMed clinical trials cipemastat
Search PubMed titles cipemastat
Search PubMed titles/abstracts cipemastat
Search UniChem for chemical match using the InChIKey GFUITADOEPNRML-SJORKVTESA-N
Search UniChem for chemicals with the same backbone GFUITADOEPNRML
Wikipedia Cipemastat