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canSAR2002064
FEATURES
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NAMES
    SMILES
    COc1ccc(-c2nnc(S)n2-c2ccc(Br)cc2)cc1OC
    InChI
    InChI=1S/C16H14BrN3O2S/c1-21-13-8-3-10(9-14(13)22-2)15-18-19-16(23)20(15)12-6-4-11(17)5-7-12/h3-9H,1-2H3,(H,19,23)
    MOLECULAR FORMULA
    C16H14BrN3O2S
    CROSS REFERENCES
    2002064 logo

    canSAR2002064

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.00
    AlogP 4.00
    HBond donors 0
    HBond acceptors 5
    Atoms 37
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2002064.