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canSAR39051
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NAMES
    SMILES
    CC(Cl)(Cl)C(NC(=O)c1cccc(Cl)c1)N/C(=N/C#N)Nc1ccc(F)nc1
    InChI
    InChI=1S/C17H14Cl3FN6O/c1-17(19,20)15(26-14(28)10-3-2-4-11(18)7-10)27-16(24-9-22)25-12-5-6-13(21)23-8-12/h2-8,15H,1H3,(H,26,28)(H2,24,25,27)
    MOLECULAR FORMULA
    C17H14Cl3FN6O
    CROSS REFERENCES
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    canSAR39051

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.03
    AlogP 3.66
    HBond donors 3
    HBond acceptors 7
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR39051.