Brief Information of the Compound and Protein
Compound Name
(2R,3S)-3-(4-Hydroxy-phenyl)-8-methyl-2-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-2,3-dihydro-benzo[1,4]oxathiin-6-ol
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PubChem ID
CID: 44325587
Canonical SMILES
Cc1cc(O)cc2S[C@H]([C@H](Oc12)c1ccc(OCCN2CCCCC2)cc1)c1ccc(O)cc1
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Compound Formula C28H31NO4S
Compound Structure
Protein Name
Estrogen receptor
Protein Classification
Transcription factor
>
Nuclear receptor
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Nuclear hormone receptor subfamily 3
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Nuclear hormone receptor subfamily 3 group A
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Nuclear hormone receptor subfamily 3 group A member 1
Uniprot ID
P03372
Gene Name
ESR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 22.6 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 5.3 nM