General
Preferred name
DEFERASIROX
Synonyms
DEFERASIROX ()
ICL 670 ()
CGP-72670 ()
ICL-670 ()
Exjade ()
Deferasirox (ICL-670) ()
CGP-72670, ICL-670 ()
Jadenu ()
ICL-670A ()
Osveral ()
Jadenu sprinkle ()
ICL670A ()
ICL670 ()
P&D ID
PD000116
CAS
201530-41-8
Tags
nuisance
natural product
drug
available
Approved by
EMA
FDA
First approval
2005
Drug Status
investigational
approved
Drug indication
Iron overload disease
Max Phase
Phase 4
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
ROE Deferasirox and metabolites are primarily (84% of the dose) excreted in the feces.; Renal excretion of deferasirox and metabolites is minimal (8% of the administered dose).
Cell lines
6
Organisms
0
Compound Sets
21
Axon Medchem Screening Library
3375
Cayman Chemical Bioactives
16753
ChEMBL Approved Drugs
CHEMBL550348
ChEMBL Drugs
CHEMBL550348
Drug Repurposing Hub
DrugBank
DB01609
DrugBank Approved Drugs
DB01609
DrugCentral
3128
DrugCentral Approved Drugs
3128
DrugMAP
DMHPRWG
DrugMAP Approved Drugs
DMHPRWG
JUMP-Target 1 Compound Set
MedChem Express Bioactive Compound Library
HY-17359
NCATS Inxight Approved Drugs
V8G4MOF2V9
NPC Screening Collection
Nuisance compounds in cellular assays
Pandemic Response Box
ReFrame library
Selleckchem Bioactive Compound Library
Deferasirox(Exjade)
TargetMol Bioactive Compound Library
T1457
The Spectrum Collection
External IDs
40
Properties
(calculated by RDKit )
Molecular Weight
373.11
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
4
cLogP
3.71
TPSA
108.47
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.5
Structural alerts
1
Chelation
Cell-permeable, Fe
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Target
Iron
CYP3A4
iron chelator
Bacterial
Ferroptosis
Ferroptosis,P450 (e.g. CYP17)
Indication
transfusional hemosiderosis, thalassemia, iron overload
MOA
chelating agent
Pathway
Anti-infection
Apoptosis
Source data