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canSAR1123521
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NAMES
    SMILES
    COc1cc(/C=C/C(=O)Nc2ccc(C)cc2N)ccc1OCC(=O)Nc1cccc(C(F)(F)F)c1
    InChI
    InChI=1S/C26H24F3N3O4/c1-16-6-9-21(20(30)12-16)32-24(33)11-8-17-7-10-22(23(13-17)35-2)36-15-25(34)31-19-5-3-4-18(14-19)26(27,28)29/h3-14H,15,30H2,1-2H3,(H,31,34)(H,32,33)/b11-8+
    MOLECULAR FORMULA
    C26H24F3N3O4
    CROSS REFERENCES
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    canSAR1123521

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.17
    AlogP 5.27
    HBond donors 4
    HBond acceptors 7
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1123521.