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canSAR1021772
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NAMES
    SMILES
    CN1CCN(c2cccc3c2C[C@H](NC(=O)c2ccc(OCC(F)(F)F)nc2)CO3)CC1
    InChI
    InChI=1S/C22H25F3N4O3/c1-28-7-9-29(10-8-28)18-3-2-4-19-17(18)11-16(13-31-19)27-21(30)15-5-6-20(26-12-15)32-14-22(23,24)25/h2-6,12,16H,7-11,13-14H2,1H3,(H,27,30)/t16-/m0/s1
    MOLECULAR FORMULA
    C22H25F3N4O3
    CROSS REFERENCES
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    canSAR1021772

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.19
    AlogP 2.51
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR1021772.