norgestimate

Ligand id: 7091

Name: norgestimate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 58.89
Molecular weight 369.23
XLogP 4.8
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
Approved drug? Yes (FDA (1989))
IUPAC Name
[(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
International Nonproprietary Names
INN number INN
3942 norgestimate
Synonyms
dexnorgestrel | ORF-10131 | RWJ-10131
Database Links
CAS Registry No. 35189-28-7
ChEBI CHEBI:50815
ChEMBL Ligand CHEMBL1200934
DrugBank Ligand DB00957
GtoPdb PubChem SID 178103669
PubChem CID 6540478
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Wikipedia Norgestimate
Comments
Norgestimate is an acetylated progestin (synthelic progesterone-like compound). It is converted to the primary active metabolite norelgestromin (17-deacetylnorgestimate or levonorgestrel 3-oxime) in vivo. 17-deacetylnorgestimate does not cause the androgenic side effects associated with other 19-nortestosterone progestins.