DROLOXIFENE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 0M67U6Z98F

Structure
InChI Key ZQZFYGIXNQKOAV-OCEACIFDSA-N
Smile CC/C(=C(/c1ccc(OCCN(C)C)cc1)c1cccc(O)c1)c1ccccc1
InChI
InChI=1S/C26H29NO2/c1-4-25(20-9-6-5-7-10-20)26(22-11-8-12-23(28)19-22)21-13-15-24(16-14-21)29-18-17-27(2)3/h5-16,19,28H,4,17-18H2,1-3H3/b26-25+

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H29NO2
Molecular Weight 387.52
AlogP 5.7
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 32.7
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 29.0

Pharmacology

Action Mechanism of Action Reference
MODULATOR Estrogen receptor modulator PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group A Nuclear hormone receptor subfamily 3 group A member 1
- - - - 29
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group A Nuclear hormone receptor subfamily 3 group A member 2
- - - - 29

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 34731
ChEMBL CHEMBL487
EPA CompTox DTXSID9022441
FDA SRS 0M67U6Z98F
Human Metabolome Database HMDB0013868
KEGG C14296
PubChem 3033767
SureChEMBL SCHEMBL4842
ZINC ZINC000001585847
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