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canSAR1719784
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NAMES
    SMILES
    Cc1cc(-c2n[nH]c3cc(NC(=O)N[C@H](c4ccccc4)C(F)(F)F)ncc23)ccn1
    InChI
    InChI=1S/C21H17F3N6O/c1-12-9-14(7-8-25-12)18-15-11-26-17(10-16(15)29-30-18)27-20(31)28-19(21(22,23)24)13-5-3-2-4-6-13/h2-11,19H,1H3,(H,29,30)(H2,26,27,28,31)/t19-/m1/s1
    MOLECULAR FORMULA
    C21H17F3N6O
    CROSS REFERENCES
    1719784 logo

    canSAR1719784

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.14
    AlogP 4.75
    HBond donors 3
    HBond acceptors 7
    Atoms 48
    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 canSAR1719784.