apixaban

Ligand id: 6390

Name: apixaban

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 110.76
Molecular weight 459.19
XLogP 2.43
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (EMA (2011), FDA (2012))
IUPAC Name
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide
International Nonproprietary Names
INN number INN
8626 apixaban
Synonyms
BMS-562247 | Eliquis®
Database Links
CAS Registry No. 503612-47-3 (source: PubChem)
ChEBI CHEBI:72296
ChEMBL Ligand CHEMBL231779
DrugBank Ligand DB06605
PubChem CID 10182969
RCSB PDB Ligand GG2
Search Google for chemical match using the InChIKey QNZCBYKSOIHPEH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QNZCBYKSOIHPEH
Search PubMed clinical trials apixaban
Search PubMed titles apixaban
Search PubMed titles/abstracts apixaban
Search UniChem for chemical match using the InChIKey QNZCBYKSOIHPEH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QNZCBYKSOIHPEH
SynPHARM 78505 (in complex with coagulation factor X)
Wikipedia Apixaban
Comments
Apixaban belongs to the direct factor Xa inhibitor family of drugs, which also includes rivaroxaban and edoxaban.