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(3R,11Br)-Tetrabenazine
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NAMES
  • (3R,11Br)-Tetrabenazine
SMILES
COc1cc2c(cc1OC)[C@H]1CC(=O)[C@H](CC(C)C)CN1CC2
InChI
InChI=1S/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16-/m1/s1
MOLECULAR FORMULA
C19H27NO3
CROSS REFERENCES
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(3R,11Br)-Tetrabenazine

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 317.20
AlogP 3.24
HBond donors 0
HBond acceptors 4
Atoms 50
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by (3R,11Br)-Tetrabenazine.