benzyl benzoate indications/contra

Stem definitionDrug idCAS RN
335 120-51-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • benzyl benzoate
  • ascabin
  • ascabiol
  • benylate
  • benzyl benzenecarboxylate
  • benzyl phenylformate
  • scobenol
  • phenylmethyl benzoate
  • Molecular weight: 212.25
  • Formula: C14H12O2
  • CLOGP: 3.94
  • LIPINSKI: 0
  • HAC: 2
  • HDO: 0
  • TPSA: 26.30
  • ALOGS: -4.03
  • ROTB: 4

Drug dosage:

None

Approvals:

DateAgencyCompanyOrphan
Sept. 2, 1976 FDA LANNETT

FDA Adverse Event Reporting System

None

Pharmacologic Action:

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SourceCodeDescription
ATC P03AX01 ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
ECTOPARASITICIDES, INCL. SCABICIDES
Other ectoparasiticides, incl. scabicides
CHEBI has role CHEBI:73333 scabicide
CHEBI has role CHEBI:22153 acaricide
MeSH PA D007306 Insecticides
MeSH PA D010575 Pesticides

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

None

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

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TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Hormone-sensitive lipase Enzyme IC50 5.96 CHEMBL
Beta-lactamase Enzyme IC50 4.05 CHEMBL

External reference:

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IDSource
4017610 VUID
N0000145990 NUI
C0053289 UMLSCUI
D01138 KEGG_DRUG
DB00676 DRUGBANK_ID
2345 PUBCHEM_CID
4017610 VANDF
N0000145990 NDFRT
N0000006158 NDFRT
4265 MMSL
19044 RXNORM
387263009 SNOMEDCT_US
48256008 SNOMEDCT_US
4821 MMSL
002992 NDDF
CHEMBL1239 ChEMBL_ID
CHEBI:41237 CHEBI
C006723 MESH_SUPPLEMENTAL_RECORD_UI
N863NB338G UNII
BZM PDB_CHEM_ID

Pharmaceutical products:

None