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canSAR1131137
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NAMES
    SMILES
    O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC2(CCc3cc(F)ccc3O2)CC1
    InChI
    InChI=1S/C21H20F4N2O2/c22-16-3-6-18-14(13-16)7-8-20(29-18)9-11-27(12-10-20)19(28)26-17-4-1-15(2-5-17)21(23,24)25/h1-6,13H,7-12H2,(H,26,28)
    MOLECULAR FORMULA
    C21H20F4N2O2
    CROSS REFERENCES
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    canSAR1131137

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.15
    AlogP 5.24
    HBond donors 1
    HBond acceptors 4
    Atoms 49
    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 canSAR1131137.