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

Stem definitionDrug idCAS RN
quaternary ammonium compounds 789 156-74-1

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • decamethonium
  • decamethonium bromide
  • syncurine
  • Molecular weight: 258.49
  • Formula: C16H38N2
  • CLOGP: -6.97
  • LIPINSKI: 0
  • HAC: 2
  • HDO: 0
  • TPSA:
  • ALOGS: -7.67
  • ROTB: 11

Drug dosage:

None

ADMET properties:

None

Approvals:

DateAgencyCompanyOrphan
May 21, 1975 FDA

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
CHEBI has role CHEBI:47958 nicotinic acetylcholine receptor agonist
CHEBI has role CHEBI:51371 muscle relaxant
MeSH PA D009465 Neuromuscular Agents
MeSH PA D009466 Neuromuscular Blocking Agents
MeSH PA D009467 Neuromuscular Depolarizing Agents
MeSH PA D018373 Peripheral Nervous System Agents

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:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Muscle-type nicotinic acetylcholine receptor Ion channel PARTIAL AGONIST CHEMBL CHEMBL
Muscarinic acetylcholine receptor M2 GPCR Ki 7.60 PDSP
Acetylcholinesterase Enzyme IC50 5.23 CHEMBL
Histamine H3 receptor GPCR IC50 6.09 CHEMBL
Acetylcholinesterase Enzyme Ki 5.46 CHEMBL
Neuronal acetylcholine receptor; alpha4/beta2 Ion channel Ki 5.24 CHEMBL

External reference:

IDSource
55C6RK944K UNII
1397 INN_ID
541-22-0 SECONDARY_CAS_RN
39514001 SNOMEDCT_US
004957 NDDF
CHEBI:41934 CHEBI
CHEMBL1134 ChEMBL_ID
CHEMBL1190 ChEMBL_ID
DB01245 DRUGBANK_ID
2968 PUBCHEM_CID
C033019 MESH_SUPPLEMENTAL_RECORD_UI

Pharmaceutical products:

None