asoprisnil

Ligand id: 2883

Name: asoprisnil

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 68.12
Molecular weight 449.26
XLogP 5.33
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(8S,11R,13S,14S,17S)-11-[4-[(E)-hydroxyiminomethyl]phenyl]-17-methoxy-17-(methoxymethyl)-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
International Nonproprietary Names
INN number INN
8202 asoprisnil
Synonyms
J-867 | J867
Database Links
CAS Registry No. 199396-76-4 (source: Scifinder)
ChEMBL Ligand CHEMBL267431
GtoPdb PubChem SID 135649967
PubChem CID 9577221
RCSB PDB Ligand AS0
Search Google for chemical match using the InChIKey GJMNAFGEUJBOCE-MEQIQULJSA-N
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Search UniChem for chemical match using the InChIKey GJMNAFGEUJBOCE-MEQIQULJSA-N
Search UniChem for chemicals with the same backbone GJMNAFGEUJBOCE
SynPHARM 6596 (in complex with Progesterone receptor)
Wikipedia Asoprisnil