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canSAR66140
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NAMES
    SMILES
    O=C(NCc1ccc(Cl)cc1)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nsnc12
    InChI
    InChI=1S/C20H14BrClN4O3S2/c21-13-6-9-15(20(27)23-11-12-4-7-14(22)8-5-12)17(10-13)26-31(28,29)18-3-1-2-16-19(18)25-30-24-16/h1-10,26H,11H2,(H,23,27)
    MOLECULAR FORMULA
    C20H14BrClN4O3S2
    CROSS REFERENCES
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    canSAR66140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 535.94
    AlogP 4.84
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR66140.