Structure

InChI Key GCKMFJBGXUYNAG-HLXURNFRSA-N
Smiles C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O
InChI
InChI=1S/C20H30O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h12,15-17,22H,4-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H30O2
Molecular Weight 302.46
AlogP 4.27
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Polar Surface Area 37.3
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 22.0

Pharmacology

Mechanism of Action Action Reference
Androgen Receptor agonist AGONIST DailyMed
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- - 3.715 - -
Rattus norvegicus
- 15.85 - - -

Target Conservation

Protein: Androgen Receptor

Description: Androgen receptor

Organism : Homo sapiens

P10275 ENSG00000169083

Related Entries

Cross References

Resources Reference
ChEBI 27436
ChEMBL CHEMBL1395
DrugBank DB06710
DrugCentral 3356
FDA SRS V9EFU16ZIF
Human Metabolome Database HMDB0015655
Guide to Pharmacology 6945
KEGG C07198
PubChem 6010
SureChEMBL SCHEMBL18657
ZINC ZINC000003814422