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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1568
CHEMBL1568
Compound Name FLUDARABINE
ChEMBL Synonyms 2-Fluoro-Ara-A | Fludarabine
Max Phase 0
Trade Names
Molecular Formula C10H12FN5O4

Additional synonyms for CHEMBL1568 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Nc1nc(F)nc2c1ncn2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O
Standard InChI InChI=1S/C10H12FN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6( ...
Download InChI
Standard InChI Key HBUBKKRHXORPQB-FJFJXFQQSA-N

Sources

  • DrugMatrix
  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1568

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
285.2 285.0873 -1.84 2 139.54 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
9 4 0 9 5 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
13.05 1.3 -.8 -.8 2 20 0.47

Structural Alerts

There are 2 structural alerts for CHEMBL1568. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:HBUBKKRHXORPQB-FJFJXFQQSA-N
PubChem SID: 144206348 SID: 144206969 SID: 170464764 SID: 855645
Wikipedia Fludarabine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1568



ACToR 21679-14-1
BindingDB 68391
Brenda 63157 136541 43675 4150 69096 51304 136583 117577 51303
ChEBI 94701
ChemicalBook CB8188247
DrugBank DB01073
eMolecules 6842904
EPA CompTox Dashboard DTXSID4039657
FDA SRS P2K93U8740
Guide to Pharmacology 4802
IBM Patent System F68B0E0220067718FFE9B52B7F6BAD08
LINCS LSM-5747
Mcule MCULE-2497721739
MolPort MolPort-006-123-542
NIH Clinical Collection SAM002548956
Nikkaji J33.087F
PubChem 657237
PubChem: Drugs of the Future 12015425
PubChem: Thomson Pharma 14751067 15222429
Selleck Fludarabine(Fludara)
SureChEMBL SCHEMBL3510
ZINC ZINC000004216238

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/HBUBKKRHXORPQB-FJFJXFQQSA-N spacer
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