benzquinamide indications/contra

Stem definitionDrug idCAS RN
331 63-12-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • benzquinamide
  • benzquinamide hydrochloride
  • emeticon
  • promecon
  • benzquinamide HCl
  • Molecular weight: 404.51
  • Formula: C22H32N2O5
  • CLOGP: 3.02
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 0
  • TPSA: 68.31
  • ALOGS: -2.92
  • ROTB: 7

Drug dosage:

None

Approvals:

DateAgencyCompanyOrphan
March 12, 1974 FDA

FDA Adverse Event Reporting System

None

Pharmacologic Action:

scroll-->
SourceCodeDescription
CHEBI has role CHEBI:50919 antiemetic
CHEBI has role CHEBI:35717 sedative
CHEBI has role CHEBI:37955 H1-receptor antagonist
CHEBI has role CHEBI:48876 muscarinic antagonist
CHEBI has role CHEBI:35476 antipsychotic agent

Drug Use (View source of the data)

scroll-->
DiseaseRelationSNOMED_IDDOID
Postoperative nausea and vomiting indication 1488000

Acid dissociation constants calculated using MoKa v3.0.0

scroll-->
Dissociation levelDissociation constantType (acidic/basic)
pKa1 6.72 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

scroll-->
TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
D(2) dopamine receptor GPCR AGONIST Ki 5.40 IUPHAR CHEMBL
Alpha-2B adrenergic receptor GPCR Ki 6.16 SCIENTIFIC LITERATURE
Alpha-2C adrenergic receptor GPCR Ki 6.26 SCIENTIFIC LITERATURE
Alpha-2A adrenergic receptor GPCR Ki 5.86 SCIENTIFIC LITERATURE
D(3) dopamine receptor GPCR Ki 5.44 PDSP
Prostaglandin G/H synthase 2 Enzyme INHIBITOR IC50 8.32 IUPHAR
D(4) dopamine receptor GPCR Ki 6.24 PDSP

External reference:

scroll-->
IDSource
4019629 VUID
N0000147722 NUI
C0053284 UMLSCUI
7124 IUPHAR_LIGAND_ID
D00243 KEGG_DRUG
0475EA27Q3 UNII
1402 INN_ID
23844-24-8 SECONDARY_CAS_RN
DB00767 DRUGBANK_ID
4019629 VANDF
N0000147722 NDFRT
N0000006407 NDFRT
19041 RXNORM
13659003 SNOMEDCT_US
400718006 SNOMEDCT_US
004681 NDDF
2342 PUBCHEM_CID
CHEMBL1200707 ChEMBL_ID
CHEMBL1201250 ChEMBL_ID
C100234 MESH_SUPPLEMENTAL_RECORD_UI
CHEBI:27662 CHEBI

Pharmaceutical products:

None