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canSAR1027246
FEATURES
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NAMES
    SMILES
    N#CC1=C(N)OC2=C(C(=O)c3ccccc3C2=O)C1c1ccc(C(F)(F)F)cc1
    InChI
    InChI=1S/C21H11F3N2O3/c22-21(23,24)11-7-5-10(6-8-11)15-14(9-25)20(26)29-19-16(15)17(27)12-3-1-2-4-13(12)18(19)28/h1-8,15H,26H2
    MOLECULAR FORMULA
    C21H11F3N2O3
    CROSS REFERENCES
    1027246 logo

    canSAR1027246

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.07
    AlogP 3.85
    HBond donors 2
    HBond acceptors 5
    Atoms 40
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1027246.