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canSAR648154
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NAMES
    SMILES
    COc1ccc(-c2sc(S(=O)(=O)NC(=O)Nc3ncc(Br)s3)cc2C)c(C)c1
    InChI
    InChI=1S/C17H16BrN3O4S3/c1-9-6-11(25-3)4-5-12(9)15-10(2)7-14(27-15)28(23,24)21-16(22)20-17-19-8-13(18)26-17/h4-8H,1-3H3,(H2,19,20,21,22)
    MOLECULAR FORMULA
    C17H16BrN3O4S3
    CROSS REFERENCES
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    canSAR648154

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 500.95
    AlogP 4.77
    HBond donors 2
    HBond acceptors 7
    Atoms 44
    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 canSAR648154.