vinblastine

Ligand id: 6851

Name: vinblastine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 154.1
Molecular weight 810.42
XLogP 4.01
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1965))
International Nonproprietary Names
INN number INN
1101 vinblastine
Synonyms
29060-LE | Velban® | Velbe® | vincaleucoblastin | vincaleukoblastine
Database Links
CAS Registry No. 865-21-4
ChEBI CHEBI:27375
ChEMBL Ligand CHEMBL159
DrugBank Ligand DB00570
PubChem CID 13342
RCSB PDB Ligand VLB
Search Google for chemical match using the InChIKey JXLYSJRDGCGARV-CFWMRBGOSA-N
Search Google for chemicals with the same backbone JXLYSJRDGCGARV
Search PubMed clinical trials vinblastine
Search PubMed titles vinblastine
Search PubMed titles/abstracts vinblastine
Search UniChem for chemical match using the InChIKey JXLYSJRDGCGARV-CFWMRBGOSA-N
Search UniChem for chemicals with the same backbone JXLYSJRDGCGARV
Wikipedia Vinblastine
Comments
A pan tubulin inhibitor. A chemical analogue of vincristine (from Catharanthus roseus, also known as Vinca rosea). There is some ambiguity surrounding the exact stereochemistry of vinblastine. The chirality shown here corresponds to the PubChem entry linked to in the table above. However, bioactivity data for the compound is also listed against CID 241903, and some of the links in the table above refer to this chiral specification or others. Marketed formulations contain vinblastine sulfate (PubChem CID 5388983).