decitabine

Ligand id: 6805

Name: decitabine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 2
Topological polar surface area 108.05
Molecular weight 229.09
XLogP -1.76
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2006), EMA (2012))
IUPAC Name
4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one
International Nonproprietary Names
INN number INN
6374 decitabine
Synonyms
5-azadeoxycytidine | azadC | DAC | Dacogen®
Database Links
CAS Registry No. 2353-33-5
ChEBI CHEBI:50131
ChEMBL Ligand CHEMBL1201129
DrugBank Ligand DB01262
PubChem CID 451668
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Wikipedia Decitabine
Comments
DNA methylation inhibitor and RNA inhibitor. Like azacitidine, decitabine inhibits DNA methylation in vitro [1], but not by directly interacting with methyltransferase enzymes.