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R7A
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NAMES
  • R7A
SMILES
CC1(C)C(Br)=C(CSS(C)(=O)=O)C(C)(C)N1O
InChI
InChI=1S/C10H18BrNO3S2/c1-9(2)7(6-16-17(5,14)15)8(11)10(3,4)12(9)13/h13H,6H2,1-5H3
MOLECULAR FORMULA
C10H18BrNO3S2
CROSS REFERENCES
  • UniChem: 9202027
  • canSAR: 1016895
  • PDBe (Protein Data Bank Europe): R7A
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R7A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 342.99
AlogP 2.59
HBond donors 1
HBond acceptors 4
Atoms 35
Contains toxicophore Yes
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by R7A.