ilomastat

Ligand id: 7409

Name: ilomastat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 5
Rotatable bonds 12
Topological polar surface area 123.32
Molecular weight 388.21
XLogP 1.93
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2R)-N'-hydroxy-N-[(2S)-3-(1H-indol-3-yl)-1-methylamino-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide
International Nonproprietary Names
INN number INN
7383 ilomastat
Synonyms
CS 610 | GM 6001
Database Links
CAS Registry No. 142880-36-2
ChEMBL Ligand CHEMBL19611
DrugBank Ligand DB02255
PubChem CID 132519
RCSB PDB Ligand GM6
Search Google for chemical match using the InChIKey NITYDPDXAAFEIT-DYVFJYSZSA-N
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Search UniChem for chemical match using the InChIKey NITYDPDXAAFEIT-DYVFJYSZSA-N
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Wikipedia GM6001
Comments
Ilomastat is a broad-spectrum inhibitor of group M10 and M12 metallopeptidases.