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canSAR345756
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NAMES
    SMILES
    CC(C)c1ncc(/C=C\C#N)n1-c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1
    InChI
    InChI=1S/C18H15F6N3O/c1-11(2)15-26-10-14(4-3-9-25)27(15)13-7-5-12(6-8-13)16(28,17(19,20)21)18(22,23)24/h3-8,10-11,28H,1-2H3/b4-3-
    MOLECULAR FORMULA
    C18H15F6N3O
    CROSS REFERENCES
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    canSAR345756

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.11
    AlogP 4.84
    HBond donors 1
    HBond acceptors 4
    Atoms 43
    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 canSAR345756.