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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1162545
CHEMBL1162545
Compound Name GLYOXYLATE
ChEMBL Synonyms 2-Oxoacetate
Max Phase 0
Trade Names
Molecular Formula C2H2O3

Additional synonyms for CHEMBL1162545 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC(=O)C=O
Standard InChI InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)
Standard InChI Key HHLFWLYXYJOTON-UHFFFAOYSA-N

Sources

  • Scientific Literature
  • TP-search Transporter Database

Alternate Forms of Compound in ChEMBL


CHEMBL1162545

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
74 74.0004 -0.41 1 54.37 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 1 0 3 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.61 - -.81 -4.53 0 5 0.34

Structural Alerts

There are 10 structural alerts for CHEMBL1162545. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:HHLFWLYXYJOTON-UHFFFAOYSA-N
Wikipedia Glyoxylic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1162545



ACToR 298-12-4
BindingDB 19472
Brenda 44639 126533 101 3343
ChEBI 16891
DrugBank DB04343
eMolecules 492774
EPA CompTox Dashboard DTXSID5021594
FDA SRS JQ39C92HH6
Human Metabolome Database HMDB0000119
IBM Patent System 0FD884E0E1B3C844661A1CF68D765CB8 8620DE67CAE727B341BE02D34B6A6728
KEGG Ligand C00048
Mcule MCULE-5307898766
Metabolights MTBLC16891
MolPort MolPort-001-788-315
Nikkaji J38.150K
PDBe GLV
PubChem 760
PubChem: Thomson Pharma 15194151
SureChEMBL SCHEMBL15868
ZINC ZINC000004658554

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