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canSAR343738
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NAMES
    SMILES
    COCC#C[C@]1(C(F)(F)F)OC(=O)Nc2ccc(Cl)cc21
    InChI
    InChI=1S/C13H9ClF3NO3/c1-20-6-2-5-12(13(15,16)17)9-7-8(14)3-4-10(9)18-11(19)21-12/h3-4,7H,6H2,1H3,(H,18,19)/t12-/m0/s1
    MOLECULAR FORMULA
    C13H9ClF3NO3
    CROSS REFERENCES
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    canSAR343738

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.02
    AlogP 3.31
    HBond donors 1
    HBond acceptors 4
    Atoms 30
    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 canSAR343738.