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canSAR1497229
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NAMES
    SMILES
    CC(=O)c1cccc(NC(=O)c2cc3nc(-c4ccc(Br)cc4)cc(C(F)(F)F)n3n2)c1
    InChI
    InChI=1S/C22H14BrF3N4O2/c1-12(31)14-3-2-4-16(9-14)27-21(32)18-11-20-28-17(13-5-7-15(23)8-6-13)10-19(22(24,25)26)30(20)29-18/h2-11H,1H3,(H,27,32)
    MOLECULAR FORMULA
    C22H14BrF3N4O2
    CROSS REFERENCES
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    canSAR1497229

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.03
    AlogP 5.63
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    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 canSAR1497229.