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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL182856
CHEMBL182856
Compound Name E350
ChEMBL Synonyms E350
Max Phase 0
Trade Names
Molecular Formula C4H4Na2O5

Additional synonyms for CHEMBL182856 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].[Na+].OC(CC(=O)[O-])C(=O)[O-]
Standard InChI InChI=1S/C4H6O5.2Na/c5-2(4(8)9)1-3(6)7;;/h2,5H,1H2,(H,6,7)(H ...
Download InChI
Standard InChI Key WPUMTJGUQUYPIV-UHFFFAOYSA-L

Alternate Forms of Compound in ChEMBL


CHEMBL182856

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
- - - - - -


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 CHEMBL182856

Compound Cross References

ChemSpider ChemSpider:WPUMTJGUQUYPIV-UHFFFAOYSA-L
PubChem SID: 144206252
Wikipedia Sodium_malate

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL182856



ACToR 676-46-0 22798-10-3 138-09-0
eMolecules 6879936
EPA CompTox Dashboard DTXSID7046831
Nikkaji J3.317K
PubChem 4691351 8736
PubChem: Thomson Pharma 15120568
SureChEMBL SCHEMBL123089

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/WPUMTJGUQUYPIV-UHFFFAOYSA-L spacer
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