semaxanib

Ligand id: 5056

Name: semaxanib

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 44.89
Molecular weight 238.11
XLogP 2.33
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
Comments
Semaxanib was a precursor in the development of the next generation kinase inhibitor ultimately approved as sunitinib.
Database Links
CAS Registry No. 194413-58-6
ChEMBL Ligand CHEMBL276711
GtoPdb PubChem SID 178101750
PubChem CID 5329098
RCSB PDB Ligand X2M
Search Google for chemical match using the InChIKey WUWDLXZGHZSWQZ-WQLSENKSSA-N
Search Google for chemicals with the same backbone WUWDLXZGHZSWQZ
Search PubMed clinical trials semaxanib
Search PubMed titles semaxanib
Search PubMed titles/abstracts semaxanib
Search UniChem for chemical match using the InChIKey WUWDLXZGHZSWQZ-WQLSENKSSA-N
Search UniChem for chemicals with the same backbone WUWDLXZGHZSWQZ
Wikipedia Semaxanib

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Tocris
SU 5416
Cat. No. 3037