clofarabine   Click here for help

GtoPdb Ligand ID: 6802

Synonyms: CAFdA | Cl-F-araA | Clolar® | Evoltra®
Approved drug PDB Ligand
clofarabine is an approved drug (FDA (2004), EMA (2009))
Compound class: Synthetic organic
Comment: A DNA polymerase (α/δ/ε) inhibitor, DNA and ribonucleoside-diphosphate reductase (RR1) inhibitor.
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 119.31
Molecular weight 303.05
XLogP 0.04
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES OCC1OC(C(C1O)F)n1cnc2c1nc(Cl)nc2N
Isomeric SMILES OC[C@H]1O[C@H]([C@H]([C@@H]1O)F)n1cnc2c1nc(Cl)nc2N
InChI InChI=1S/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)/t3-,4+,6-,9-/m1/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2004), EMA (2009))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
8422 clofarabine
Synonyms Click here for help
CAFdA | Cl-F-araA | Clolar® | Evoltra®
Database Links Click here for help
CAS Registry No. 23318-82-1
ChEMBL Ligand CHEMBL1750
DrugBank Ligand DB00631
DrugCentral Ligand 691
GtoPdb PubChem SID 178103408
PubChem CID 119182
Search Google for chemical match using the InChIKey WDDPHFBMKLOVOX-AYQXTPAHSA-N
Search Google for chemicals with the same backbone WDDPHFBMKLOVOX
Search PubMed clinical trials clofarabine
Search PubMed titles clofarabine
Search PubMed titles/abstracts clofarabine
UniChem Compound Search for chemical match using the InChIKey WDDPHFBMKLOVOX-AYQXTPAHSA-N
UniChem Connectivity Search for chemical match using the InChIKey WDDPHFBMKLOVOX-AYQXTPAHSA-N
Wikipedia Clofarabine

Product suppliers

View disclaimer

Clofarabine (links to external site)
Cat. No. 2600