tetrahydrodeoxycorticosterone

Ligand id: 4321

Name: tetrahydrodeoxycorticosterone

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 57.53
Molecular weight 334.25
XLogP 5.06
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
2-hydroxy-1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
Database Links
CAS Registry No. 567-03-3 (source: Scifinder)
ChEMBL Ligand CHEMBL1256760
PubChem CID 101771
Search Google for chemical match using the InChIKey CYKYBWRSLLXBOW-GDYGHMJCSA-N
Search Google for chemicals with the same backbone CYKYBWRSLLXBOW
Search UniChem for chemical match using the InChIKey CYKYBWRSLLXBOW-GDYGHMJCSA-N
Search UniChem for chemicals with the same backbone CYKYBWRSLLXBOW
Wikipedia Tetrahydrodeoxycorticosterone