GESTODENE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: Parent
UNII: 1664P6E6MI

Structure
InChI Key SIGSPDASOTUPFS-XUDSTZEESA-N
Smile C#C[C@]1(O)C=C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
InChI
InChI=1S/C21H26O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,10,12-13,16-19,23H,3,5-9,11H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H26O2
Molecular Weight 310.44
AlogP 3.66
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 37.3
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 23.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Progesterone receptor agonist PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 60282-87-3
ChEBI 135323
ChEMBL CHEMBL1213583
DrugBank DB06730
DrugCentral 1291
EPA CompTox DTXSID6046478
FDA SRS 1664P6E6MI
Human Metabolome Database HMDB0015668
Guide to Pharmacology 11246
PharmGKB PA165958397
PubChem 3033968
SureChEMBL SCHEMBL37271
ZINC ZINC000238809420
CONTENTS