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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL25164
CHEMBL25164
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C15H24O5

Additional synonyms for CHEMBL25164 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C[C@@H]1CC[C@H]2[C@@H](C)C(O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@ ...
Download SMILES
Standard InChI InChI=1S/C15H24O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7 ...
Download InChI
Standard InChI Key BJDCWCLMFKKGEE-HVDUHBCDSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL25164

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
284.4 284.1624 2.19 0 57.15 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
5 1 0 5 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.62 - 2.19 2.19 0 20 0.69

Structural Alerts

There are 8 structural alerts for CHEMBL25164. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:BJDCWCLMFKKGEE-HVDUHBCDSA-N
Wikipedia Dihydroartemisinin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL25164



BindingDB 50088446
ChEBI 207229
DrugBank DB11638
IBM Patent System E1859775E4CE178278AEF1F4C5BB432F
MolPort MolPort-046-069-207
Nikkaji J2.175.995C
PubChem 6918483
PubChem: Drugs of the Future 12015359
PubChem: Thomson Pharma 16218297
SureChEMBL SCHEMBL60968

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