semaxanib

Ligand id: 5056

Name: semaxanib

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 44.89
Molecular weight 238.11
XLogP 3.49
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2,3-dihydro-1H-indol-2-one
International Nonproprietary Names
INN number INN
8004 semaxanib
Synonyms
SU 5416 | SU5416 | VEGF receptor 2 kinase inhibitor III
Database Links
CAS Registry No. 194413-58-6
ChEMBL Ligand CHEMBL276711
PubChem CID 5329098
RCSB PDB Ligand X2M
Search Google for chemical match using the InChIKey WUWDLXZGHZSWQZ-WQLSENKSSA-N
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Search UniChem for chemical match using the InChIKey WUWDLXZGHZSWQZ-WQLSENKSSA-N
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Wikipedia Semaxanib
Comments
Semaxanib was a precursor in the development of the next generation kinase inhibitor ultimately approved as sunitinib.