Structure

InChI Key XWALNWXLMVGSFR-HLXURNFRSA-N
Smile C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O
InChI
InChI=1S/C20H28O2/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/h6,9,12,15-17,22H,4-5,7-8,10-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H28O2
Molecular Weight 300.44
AlogP 4.05
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 37.3
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Androgen Receptor agonist ISBN PubMed PubMed PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 6810
ChEMBL CHEMBL1418176
DrugBank DB13586
DrugCentral 1734
EPA CompTox DTXSID2023276
FDA SRS COZ1R7EOCC
Human Metabolome Database HMDB0041925
PubChem 6300
SureChEMBL SCHEMBL140928
ZINC ZINC000003875469