brivanib alinate

Ligand id: 8097

Name: brivanib alinate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 116.76
Molecular weight 441.18
XLogP 2.53
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Is prodrug? Yes
Active form brivanib
IUPAC Name
[(2R)-1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[5,1-f][1,2,4]triazin-6-yl]oxypropan-2-yl] (2S)-2-aminopropanoate
International Nonproprietary Names
INN number INN
8879 brivanib alaninate
Synonyms
BMS-582664 | BMS582664
Database Links
CAS Registry No. 649735-63-7
ChEMBL Ligand CHEMBL270995
PubChem CID 11154925
Search Google for chemical match using the InChIKey LTEJRLHKIYCEOX-OCCSQVGLSA-N
Search Google for chemicals with the same backbone LTEJRLHKIYCEOX
Search PubMed clinical trials brivanib alaninate
Search PubMed titles brivanib alaninate
Search PubMed titles/abstracts brivanib alaninate
Search UniChem for chemical match using the InChIKey LTEJRLHKIYCEOX-OCCSQVGLSA-N
Search UniChem for chemicals with the same backbone LTEJRLHKIYCEOX
Wikipedia Brivanib alaninate