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canSAR1064894
FEATURES
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NAMES
    SMILES
    CC(O)CC1=C(Br)C(=O)c2ccccc2C1=O
    InChI
    InChI=1S/C13H11BrO3/c1-7(15)6-10-11(14)13(17)9-5-3-2-4-8(9)12(10)16/h2-5,7,15H,6H2,1H3
    MOLECULAR FORMULA
    C13H11BrO3
    CROSS REFERENCES
    1064894 logo

    canSAR1064894

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 293.99
    AlogP 2.49
    HBond donors 1
    HBond acceptors 3
    Atoms 28
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1064894.