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canSAR78013
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NAMES
    SMILES
    Cc1ccc(OCc2sccc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1
    InChI
    InChI=1S/C17H17BrN2O4S2/c1-10-4-5-13(11(2)8-10)23-9-14-15(6-7-25-14)26(21,22)20-17-16(18)12(3)19-24-17/h4-8,20H,9H2,1-3H3
    MOLECULAR FORMULA
    C17H17BrN2O4S2
    CROSS REFERENCES
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    canSAR78013

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.98
    AlogP 4.80
    HBond donors 1
    HBond acceptors 6
    Atoms 43
    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 canSAR78013.