canSAR2170606
FEATURES
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NAMES
    SMILES
    [2H]C([2H])([2H])Oc1cc(OC([2H])([2H])[2H])cc(N(c2ccc3ncc(-c4cnn(C)c4)nc3c2)C([2H])([2H])C([2H])([2H])C([2H])([2H])NCC(F)(F)F)c1
    InChI
    InChI=1S/C25H27F3N6O2/c1-33-15-17(13-31-33)24-14-30-22-6-5-18(11-23(22)32-24)34(8-4-7-29-16-25(26,27)28)19-9-20(35-2)12-21(10-19)36-3/h5-6,9-15,29H,4,7-8,16H2,1-3H3/i2D3,3D3,4D2,7D2,8D2
    MOLECULAR FORMULA
    C25H27F3N6O2
    CROSS REFERENCES
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    canSAR2170606
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight512.29
    AlogP4.73
    HBond donors1
    HBond acceptors8
    Atoms63
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2170606.