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canSAR159382
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NAMES
    SMILES
    COc1cccc(OC)c1-c1ccc(CC(Nc2ccc(C(F)(F)F)cn2)C(=O)O)cc1
    InChI
    InChI=1S/C23H21F3N2O4/c1-31-18-4-3-5-19(32-2)21(18)15-8-6-14(7-9-15)12-17(22(29)30)28-20-11-10-16(13-27-20)23(24,25)26/h3-11,13,17H,12H2,1-2H3,(H,27,28)(H,29,30)
    MOLECULAR FORMULA
    C23H21F3N2O4
    CROSS REFERENCES
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    canSAR159382

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.15
    AlogP 4.89
    HBond donors 2
    HBond acceptors 6
    Atoms 53
    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 canSAR159382.