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canSAR1018656
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NAMES
    SMILES
    C[C@@H](NC(C)(C)C)[C@H](O)c1cccc(Br)c1
    InChI
    InChI=1S/C13H20BrNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,12,15-16H,1-4H3/t9-,12+/m1/s1
    MOLECULAR FORMULA
    C13H20BrNO
    CROSS REFERENCES
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    canSAR1018656

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 285.07
    AlogP 3.26
    HBond donors 2
    HBond acceptors 2
    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 canSAR1018656.