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canSAR755955
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NAMES
    SMILES
    O=S(=O)(c1ccc(Br)cc1)c1ccc(-c2nnc3n2N=C(Nc2ccccc2)CS3)cc1
    InChI
    InChI=1S/C22H16BrN5O2S2/c23-16-8-12-19(13-9-16)32(29,30)18-10-6-15(7-11-18)21-25-26-22-28(21)27-20(14-31-22)24-17-4-2-1-3-5-17/h1-13H,14H2,(H,24,27)
    MOLECULAR FORMULA
    C22H16BrN5O2S2
    CROSS REFERENCES
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    canSAR755955

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.99
    AlogP 4.92
    HBond donors 1
    HBond acceptors 7
    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 canSAR755955.