17Alpha-3'-Bromobenzyl Estradiol
FEATURES
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NAMES
  • 17Alpha-3'-Bromobenzyl Estradiol
SMILES
C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@]2(O)Cc1cccc(Br)c1
InChI
InChI=1S/C25H29BrO2/c1-24-11-9-21-20-8-6-19(27)14-17(20)5-7-22(21)23(24)10-12-25(24,28)15-16-3-2-4-18(26)13-16/h2-4,6,8,13-14,21-23,27-28H,5,7,9-12,15H2,1H3/t21-,22-,23+,24+,25-/m1/s1
MOLECULAR FORMULA
C25H29BrO2
CROSS REFERENCES
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17Alpha-3'-Bromobenzyl Estradiol
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight440.14
AlogP5.98
HBond donors2
HBond acceptors2
Atoms57
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 17Alpha-3'-Bromobenzyl Estradiol.