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

Stem definitionDrug idCAS RN
1526 469-79-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • ketobemidone
  • cetobemidon
  • cetobemidone
  • cliradon
  • cliradone
  • Molecular weight: 247.34
  • Formula: C15H21NO2
  • CLOGP: 1.17
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 1
  • TPSA: 40.54
  • ALOGS: -1.91
  • ROTB: 3

Drug dosage:

DoseUnitRoute
50 mg O
50 mg P

ADMET properties:

PropertyValueReference
MRTD (Maximum Recommended Therapeutic Daily Dose) 3.47 ┬ÁM/kg/day Contrera JF, Matthews EJ, Kruhlak NL, Benz RD
BA (Bioavailability) 34 % Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H
Vd (Volume of distribution) 0.48 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 9.20 mL/min/kg Lombardo F, Berellini G, Obach RS
t_half (Half-life) 2.30 hours Lombardo F, Berellini G, Obach RS

Approvals:

DateAgencyCompanyOrphan
Jan. 1, 1947 YEAR INTRODUCED

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
ATC N02AB01 NERVOUS SYSTEM
ANALGESICS
OPIOIDS
Phenylpiperidine derivatives
ATC N02AG02 NERVOUS SYSTEM
ANALGESICS
OPIOIDS
Opioids in combination with antispasmodics
MeSH PA D000700 Analgesics
MeSH PA D000701 Analgesics, Opioid
MeSH PA D002491 Central Nervous System Agents
MeSH PA D002492 Central Nervous System Depressants
MeSH PA D018691 Excitatory Amino Acid Antagonists
MeSH PA D009294 Narcotics
MeSH PA D018377 Neurotransmitter Agents
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 9.35 acidic
pKa2 8.84 Basic

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
Delta-type opioid receptor GPCR Ki 6.84 WOMBAT-PK
Glutamate receptor ionotropic, NMDA 3A Ion channel Ki 4.59 WOMBAT-PK
Kappa-type opioid receptor GPCR Ki 6.22 WOMBAT-PK
Mu-type opioid receptor GPCR EC50 9 WOMBAT-PK
Opioid receptor GPCR IC50 5.15 CHEMBL
Opioid receptor GPCR EC50 8.70 CHEMBL

External reference:

IDSource
D08100 KEGG_DRUG
C0064311 UMLSCUI
CHEBI:6125 CHEBI
CHEMBL47072 ChEMBL_ID
CHEMBL259124 ChEMBL_ID
DB06738 DRUGBANK_ID
C012394 MESH_SUPPLEMENTAL_RECORD_UI
10101 PUBCHEM_CID
1274 INN_ID
PQS1L514CF UNII
015273 NDDF
96190002 SNOMEDCT_US

Pharmaceutical products:

None