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canSAR1687137
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NAMES
    SMILES
    CCOC(=O)c1cccc(NC(=O)CCS(=O)(=O)c2ccc(Br)s2)c1
    InChI
    InChI=1S/C16H16BrNO5S2/c1-2-23-16(20)11-4-3-5-12(10-11)18-14(19)8-9-25(21,22)15-7-6-13(17)24-15/h3-7,10H,2,8-9H2,1H3,(H,18,19)
    MOLECULAR FORMULA
    C16H16BrNO5S2
    CROSS REFERENCES
    1687137 logo

    canSAR1687137

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.97
    AlogP 3.49
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1687137.