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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL267373
CHEMBL267373
Compound Name BENZAMIDE
ChEMBL Synonyms BENZAMIDE
Max Phase 0
Trade Names
Molecular Formula C7H7NO

Additional synonyms for CHEMBL267373 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NC(=O)c1ccccc1
Standard InChI InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
Standard InChI Key KXDAEFPNCMNJSK-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL267373

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
121.1 121.0528 0.83 1 43.09 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - .75 .75 1 9 0.59

Structural Alerts

There are no structural alerts for CHEMBL267373

Compound Cross References

ChemSpider ChemSpider:KXDAEFPNCMNJSK-UHFFFAOYSA-N
PubChem SID: 11110833 SID: 11532898 SID: 144207819 SID: 17389650 SID: 50105578 SID: 85230934 SID: 90341419
Wikipedia Benzamide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL267373



ACToR 27208-38-4 55-21-0
BindingDB 50106187
Brenda 97448 1408 105483
ChEBI 28179
eMolecules 479292 27677655
EPA CompTox Dashboard DTXSID0021709
FDA SRS 6X80438640
Human Metabolome Database HMDB0004461
IBM Patent System 2B068124EE6B717E5FE71B8621AF3246
KEGG Ligand C09815
Mcule MCULE-2811211507
MolPort MolPort-001-497-861
Nikkaji J1.374I
NMRShiftDB 10008844
PDBe UNU
PubChem 2331
PubChem: Thomson Pharma 15242870
SureChEMBL SCHEMBL16352
ZINC ZINC000000152996

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