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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL27577
CHEMBL27577
Compound Name SALICYLAMIDE
ChEMBL Synonyms SALICYLAMIDE
Max Phase 0
Trade Names
Molecular Formula C7H7NO2

Additional synonyms for CHEMBL27577 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NC(=O)c1ccccc1O
Standard InChI InChI=1S/C7H7NO2/c8-7(10)5-3-1-2-4-6(5)9/h1-4,9H,(H2,8,10)
Standard InChI Key SKZKKFZAGNVIMN-UHFFFAOYSA-N

Sources

  • AstraZeneca Deposited Data
  • DrugMatrix
  • PubChem BioAssays
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL27577

Molecule Features

CHEMBL27577 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
PainD010146EFO:0003843pain0ATC
ATC
ATC
FeverD005334HP:0001945fever0ATC
ATC
ATC

Clinical Data

ClinicalTrials.gov SALICYLAMIDE
The Cochrane Collaboration SALICYLAMIDE

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
137.1 137.0477 0.49 1 63.32 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 2 0 3 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
8.37 - 1.35 1.3 1 10 0.59

Structural Alerts

There are no structural alerts for CHEMBL27577

Compound Cross References

ATC N - NERVOUS SYSTEM
N02 - ANALGESICS
N02B - OTHER ANALGESICS AND ANTIPYRETICS
N02BA - Salicylic acid and derivatives
N02BA75 - salicylamide, combinations with psycholeptics

N - NERVOUS SYSTEM
N02 - ANALGESICS
N02B - OTHER ANALGESICS AND ANTIPYRETICS
N02BA - Salicylic acid and derivatives
N02BA05 - salicylamide

N - NERVOUS SYSTEM
N02 - ANALGESICS
N02B - OTHER ANALGESICS AND ANTIPYRETICS
N02BA - Salicylic acid and derivatives
N02BA55 - salicylamide, combinations excl. psycholeptics

ChemSpider ChemSpider:SKZKKFZAGNVIMN-UHFFFAOYSA-N
PubChem SID: 144204680 SID: 144209142 SID: 144213118 SID: 170465496 SID: 17389647 SID: 26747354 SID: 8139933
Wikipedia Salicylamide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL27577



ACToR 65-45-2
BindingDB 50056900
Brenda 16901 20511
ChEBI 32114
ChemicalBook CB4854078
DrugBank DB08797
DrugCentral 2415
eMolecules 476454
EPA CompTox Dashboard DTXSID3021726
FDA SRS EM8BM710ZC
Human Metabolome Database HMDB0015687
IBM Patent System CD1E72451E0FB393A5E1D843230F80EF
Mcule MCULE-5482995635
MolPort MolPort-001-641-072
Nikkaji J1.408G
NMRShiftDB 10008875
PDBe OHB
PubChem 5147
PubChem: Thomson Pharma 15120009
SureChEMBL SCHEMBL21646
ZINC ZINC000000002055

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