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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL369611
CHEMBL369611
Compound Name SODIUM FLUOROACETATE
ChEMBL Synonyms Sodium Fluoro-Acetate
Max Phase 0
Trade Names
Molecular Formula C2H2FO2.Na

Additional synonyms for CHEMBL369611 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].[O-]C(=O)CF
Standard InChI InChI=1S/C2H3FO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1
Standard InChI Key JGFYQVQAXANWJU-UHFFFAOYSA-M

Structural Alerts

There are 5 structural alerts for CHEMBL369611. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL369611

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
78 78.0117 0.06 1 37.29 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 0 2 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.62 - -.11 -3.82 0 5 0.48

Compound Cross References

ChemSpider ChemSpider:JGFYQVQAXANWJU-UHFFFAOYSA-M
PubChem SID: 144211737 SID: 26749788
Wikipedia Sodium_fluoroacetate

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL369611



ACToR 62-74-8
ChEBI 38699
eMolecules 910854
FDA SRS 166WTM3843
KEGG Ligand C18588
Nikkaji J2.353A
PubChem 16212360
PubChem: Thomson Pharma 15296980
SureChEMBL SCHEMBL226060

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