fenbufen Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
non-steroidal anti-inflammatory agents, arylbutanoic acid derivatives 1145 36330-85-5

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • fenbufen
  • bufemid
  • lederfen
  • napanol
an orally active nonsteroidal anti-inflammatory drug with analgesic and antipyretic activity
  • Molecular weight: 254.29
  • Formula: C16H14O3
  • CLOGP: 3.14
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 1
  • TPSA: 54.37
  • ALOGS: -4.32
  • ROTB: 5

Drug dosage:

DoseUnitRoute
0.60 g O

ADMET properties:

PropertyValueReference
MRTD (Maximum Recommended Therapeutic Daily Dose) 50.56 ┬ÁM/kg/day Contrera JF, Matthews EJ, Kruhlak NL, Benz RD
BA (Bioavailability) 78 % Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
ATC M01AE05 MUSCULO-SKELETAL SYSTEM
ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Propionic acid derivatives
MeSH PA D000700 Analgesics
MeSH PA D018712 Analgesics, Non-Narcotic
CHEBI has role CHEBI:35475 non-steroidal anti-inflammatory drug
MeSH PA D000893 Anti-Inflammatory Agents
MeSH PA D000894 Anti-Inflammatory Agents, Non-Steroidal
MeSH PA D018501 Antirheumatic Agents
MeSH PA D016861 Cyclooxygenase Inhibitors
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D018373 Peripheral Nervous System Agents
MeSH PA D018689 Sensory System Agents

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 4.68 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Prostaglandin G/H synthase 1 Enzyme INHIBITOR WOMBAT-PK SCIENTIFIC LITERATURE
Prostaglandin G/H synthase 2 Enzyme INHIBITOR WOMBAT-PK SCIENTIFIC LITERATURE
Prostaglandin G/H synthase 2 Enzyme IC50 5.09 CHEMBL
Prostaglandin G/H synthase 1 Enzyme IC50 5.41 CHEMBL

External reference:

IDSource
C0060156 UMLSCUI
D01344 KEGG_DRUG
329623001 SNOMEDCT_US
24830 RXNORM
396052008 SNOMEDCT_US
004090 NDDF
9815R1WR9B UNII
3439 INN_ID
CHEBI:31599 CHEBI
CHEMBL277522 ChEMBL_ID
DB08981 DRUGBANK_ID
3335 PUBCHEM_CID
C010725 MESH_SUPPLEMENTAL_RECORD_UI
DB07477 DRUGBANK_ID

Pharmaceutical products:

None