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canSAR1020976
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NAMES
    SMILES
    CC(C(=O)O)c1c(F)cc(CC2CCCC2=O)cc1Br
    InChI
    InChI=1S/C15H16BrFO3/c1-8(15(19)20)14-11(16)6-9(7-12(14)17)5-10-3-2-4-13(10)18/h6-8,10H,2-5H2,1H3,(H,19,20)
    MOLECULAR FORMULA
    C15H16BrFO3
    CROSS REFERENCES
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    canSAR1020976

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.03
    AlogP 3.69
    HBond donors 1
    HBond acceptors 3
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1020976.