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

Stem definitionDrug idCAS RN
steroids not used as glucocorticosteroids 997 128-20-1

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • eltanolone
  • pregnanolone
A pregnane found in the urine of pregnant women and sows. It has anesthetic, hypnotic, and sedative properties.
  • Molecular weight: 318.50
  • Formula: C21H34O2
  • CLOGP: 4.51
  • LIPINSKI: 0
  • HAC: 2
  • HDO: 1
  • TPSA: 37.30
  • ALOGS: -5.37
  • ROTB: 1

Drug dosage:

None

ADMET properties:

PropertyValueReference
Vd (Volume of distribution) 2 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 22 mL/min/kg Lombardo F, Berellini G, Obach RS
fu (Fraction unbound in plasma) 0.01 % Lombardo F, Berellini G, Obach RS
t_half (Half-life) 4.70 hours Lombardo F, Berellini G, Obach RS

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
CHEBI has role CHEBI:35717 sedatives
CHEBI has role CHEBI:38877 intravenous anesthetics
CHEBI has role CHEBI:77746 h. sapiens metabolites
MeSH PA D000777 Anesthetics
MeSH PA D002491 Central Nervous System Agents
MeSH PA D002492 Central Nervous System Depressants

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
GABA-A receptor alpha-1/beta-2/gamma-2 Ion channel IC50 7.30 WOMBAT-PK
GABA-A receptor; anion channel Ion channel IC50 7.36 CHEMBL

External reference:

IDSource
C0033008 UMLSCUI
CHEBI:1712 CHEBI
P9N PDB_CHEM_ID
CHEMBL210952 ChEMBL_ID
DB12308 DRUGBANK_ID
D011280 MESH_DESCRIPTOR_UI
31402 PUBCHEM_CID
11534 IUPHAR_LIGAND_ID
6781 INN_ID
BXO86P3XXW UNII

Pharmaceutical products:

None