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canSAR1201449
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NAMES
    SMILES
    COc1cc(C(F)(F)F)cc(C(F)(F)F)c1C(=O)NC1(c2ccccc2)CCCNC1
    InChI
    InChI=1S/C21H20F6N2O2/c1-31-16-11-14(20(22,23)24)10-15(21(25,26)27)17(16)18(30)29-19(8-5-9-28-12-19)13-6-3-2-4-7-13/h2-4,6-7,10-11,28H,5,8-9,12H2,1H3,(H,29,30)
    MOLECULAR FORMULA
    C21H20F6N2O2
    CROSS REFERENCES
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    canSAR1201449

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.14
    AlogP 4.74
    HBond donors 2
    HBond acceptors 4
    Atoms 51
    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 canSAR1201449.