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canSAR1973549
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NAMES
    SMILES
    O=C(Nc1cnn2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)nc12)C(=O)NC1CC1
    InChI
    InChI=1S/C21H20F2N6O2/c22-12-3-6-15(23)14(10-12)17-2-1-8-28(17)18-7-9-29-19(27-18)16(11-24-29)26-21(31)20(30)25-13-4-5-13/h3,6-7,9-11,13,17H,1-2,4-5,8H2,(H,25,30)(H,26,31)/t17-/m1/s1
    MOLECULAR FORMULA
    C21H20F2N6O2
    CROSS REFERENCES
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    canSAR1973549

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.16
    AlogP 2.57
    HBond donors 2
    HBond acceptors 8
    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 canSAR1973549.