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Ligand

NameFemring
Molecular formulaC20H26O3
IUPAC name[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate
Molecular weight314.425
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.8
Synonyms3-O-Acetylestradiol
D0T7ZQ
Estra-1,3,5(10)-triene-3,17-diol, (17 beta)-, 3-acetate
17beta-Hydroxyestra-1,3,5(10)-trien-3-yl acetate
beta-Estradiol 3-acetate
[ Show all ]
Inchi KeyFHXBMXJMKMWVRG-SLHNCBLASA-N
Inchi IDInChI=1S/C20H26O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19+,20+/m1/s1
PubChem CID9818306
ChEMBLN/A
IUPHARN/A
BindingDBN/A
DrugBankDB13952

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548810G-protein coupled estrogen receptor 1Q99527GPER1Homo sapiens (Human)375

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