General
Preferred name
ETHYNODIOL DIACETATE
Synonyms
Ethynodiol acetate ()
8080 CB ()
etynodiol ()
8080 CB,Ethynodiol acetate ()
Femulen ()
Etynodiol Acetate ()
Etynodiol diacetate ()
SC 11800 ()
SC-11800 ()
NSC-759288 ()
P&D ID
PD009703
CAS
297-76-7
8056-92-6
Tags
prodrug
natural product
drug
available
Approved by
FDA
First approval
1966
Drug Status
approved
Drug indication
Progestin
Contraception
Max Phase
Phase 4
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 This compound is a progestin. (GtoPdb)
DESCRIPTION Ethynodiol diacetate is one of the first synthetic progestogens used in contraceptive pills.Relative to other 19-nortestosterone derivatives, it has relatively little or no potency as an androgen and also unlike most progestins in general, has significant estrogenic effects. (BOC Sciences Bioactive Compounds)
Compound Sets
19
BOC Sciences Bioactive Compounds
ethynodiol-diacetate-cas-297-76-7-item-84-65408
Cayman Chemical Bioactives
29854
ChEMBL Approved Drugs
CHEMBL1200624
ChEMBL Drugs
CHEMBL1200624
Drug Repurposing Hub
DrugBank
DB00823
DrugBank Approved Drugs
DB00823
DrugCentral
1095
DrugCentral Approved Drugs
1095
DrugMAP
DMZM84R
DrugMAP Approved Drugs
DMZM84R
Guide to Pharmacology
7072
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL1200624
MedChem Express Bioactive Compound Library
HY-B1089
NPC Screening Collection
Prestwick Chemical Library
ReFrame library
Selleckchem Bioactive Compound Library
ethynodiol-diacetate
TargetMol Bioactive Compound Library
T0996
External IDs
34
Properties
(calculated by RDKit )
Molecular Weight
384.23
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
4
Aromatic Ring Count
0
cLogP
4.43
TPSA
52.6
Fraction CSP3
0.75
Chiral centers
7.0
Largest ring
6.0
QED
0.4
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Endocrinology/Hormones
Vitamin D Related/Nuclear Receptor
Target
ER
ESR1, PGR
Progesterone Receptor
Estrogen/progestogen Receptor
Indication
contraceptive
Therapeutic Class
Contraceptive Agents
Source data