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canSAR1446458
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NAMES
    SMILES
    CCOC(=O)c1c2c(n(C)c1C)C(=O)C(=O)c1ccc(Br)cc1-2
    InChI
    InChI=1S/C17H14BrNO4/c1-4-23-17(22)12-8(2)19(3)14-13(12)11-7-9(18)5-6-10(11)15(20)16(14)21/h5-7H,4H2,1-3H3
    MOLECULAR FORMULA
    C17H14BrNO4
    CROSS REFERENCES
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    canSAR1446458

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.01
    AlogP 3.32
    HBond donors 0
    HBond acceptors 5
    Atoms 37
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1446458.