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canSAR990127
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NAMES
    SMILES
    COc1ccc2c(c1)c(C1CCN(C)C1)cn2S(=O)(=O)c1ccccc1Br
    InChI
    InChI=1S/C20H21BrN2O3S/c1-22-10-9-14(12-22)17-13-23(19-8-7-15(26-2)11-16(17)19)27(24,25)20-6-4-3-5-18(20)21/h3-8,11,13-14H,9-10,12H2,1-2H3
    MOLECULAR FORMULA
    C20H21BrN2O3S
    CROSS REFERENCES
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    canSAR990127

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.05
    AlogP 4.07
    HBond donors 0
    HBond acceptors 5
    Atoms 48
    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 canSAR990127.