General
Preferred name
DIETHYLSTILBESTROL
Synonyms
Stilbestrol ()
DES ()
(E)-diethylstilbestrol ()
Stilboesterol ()
Stilbetin ()
Cyren A ()
Stilbestro ()
Stilboestrol ()
Tampovagan ()
Distilbene ()
New-Estranol 1 ()
Apstil ()
Estrogenine ()
Synthestrin ()
Fonatol ()
Dietilestilbestrol ()
Estromenin ()
Stilbestroform ()
Palestrol ()
Synestrin ()
NSC-3070 ()
Estrobene ()
estrogen ()
P&D ID
PD002375
CAS
56-53-1
22610-99-7
Tags
available
drug
Approved by
FDA
First approval
1973
Drug indication
Gonorrheal vaginitis
Drug Status
approved
withdrawn
investigational
Max Phase
4.0
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Nonsteroidal estrogen receptor alpha (ERĪ±) agonist. (GtoPdb)
Cell lines
5
Organisms
1
Compound Sets
26
Axon Medchem Screening Library
3320
Cayman Chemical Bioactives
10006876
ChEMBL Approved Drugs
CHEMBL411
ChEMBL Drugs
CHEMBL411
CZ-OPENSCREEN Bioactive Library
Drug Repurposing Hub
DrugBank
DB00255
DrugBank Approved Drugs
DB00255
DrugCentral
875
DrugCentral Approved Drugs
875
DrugMAP
DMN3UXQ
DrugMAP Approved Drugs
DMN3UXQ
Enamine BioReference Compounds
EU-OPENSCREEN Bioactive Compound Library
EOS101575
Guide to Pharmacology
2801
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL411
MedChem Express Bioactive Compound Library
HY-14598
Novartis Chemogenetic Library (NIBR MoA Box)
NPC Screening Collection
NURSA ligand set
nursa/index.jsf?doi=10.1621%2FGYGXGQW5SL
Prestwick Chemical Library
ReFrame library
Selleckchem Bioactive Compound Library
Diethylstilbestrol(Stilbestrol)
TargetMol Bioactive Compound Library
T1216
The Spectrum Collection
Withdrawn 2.0
w119
External IDs
40
Properties
(calculated by RDKit )
Molecular Weight
268.15
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
2
cLogP
4.83
TPSA
40.46
Fraction CSP3
0.22
Chiral centers
0.0
Largest ring
6.0
QED
0.78
QED
0.78
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Endocrinology/Hormones
Apoptosis
Autophagy
Vitamin D Related/Nuclear Receptor
Target
ER
ESR1, ESR2, ESRRB, ESRRG
ER-a agonist
Estrogen Receptor/ERR
Estrogen/progestogen Receptor
Member status
member
MOA
Chloride Channel Blockers
Estrogen Receptor (ER) Agonists
Estrogen receptor agonist
ATC
G03CB02
L02AA01
Toxicity type
reproductive
Therapeutic Class
Anticancer Agents
Source data