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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL590010
CHEMBL590010
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C35H43Na13O60S13

Additional synonyms for CHEMBL590010 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]. ...
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Standard InChI InChI=1S/C35H56O60S13.13Na/c1-2-3-4-14-5-7-15(8-6-14)9-75-32 ...
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Standard InChI Key ZAVNYVFLUWJHCC-UDEMFVDUSA-A

Alternate Forms of Compound in ChEMBL


CHEMBL590010

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
1853.6 1851.77 - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


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

Structural Alerts

There are no structural alerts for CHEMBL590010

Compound Cross References

ChemSpider ChemSpider:ZAVNYVFLUWJHCC-UDEMFVDUSA-A

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL590010



PubChem 45103697
PubChem: Thomson Pharma 92122526

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/ZAVNYVFLUWJHCC-UDEMFVDUSA-A spacer
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