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canSAR1971496
FEATURES
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NAMES
    SMILES
    Cn1cc(-c2cc(OCC(=O)O)cc3c2-c2ccccc2C3(O)C(F)(F)F)cn1
    InChI
    InChI=1S/C20H15F3N2O4/c1-25-9-11(8-24-25)14-6-12(29-10-17(26)27)7-16-18(14)13-4-2-3-5-15(13)19(16,28)20(21,22)23/h2-9,28H,10H2,1H3,(H,26,27)
    MOLECULAR FORMULA
    C20H15F3N2O4
    CROSS REFERENCES
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    canSAR1971496

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.10
    AlogP 3.33
    HBond donors 2
    HBond acceptors 6
    Atoms 44
    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 canSAR1971496.