512
FEATURES
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NAMES
  • 512
SMILES
O=C(O)COc1c(Br)csc1C(=O)O
InChI
InChI=1S/C7H5BrO5S/c8-3-2-14-6(7(11)12)5(3)13-1-4(9)10/h2H,1H2,(H,9,10)(H,11,12)
MOLECULAR FORMULA
C7H5BrO5S
CROSS REFERENCES
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512
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight279.90
AlogP1.67
HBond donors2
HBond acceptors5
Atoms19
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 512.