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canSAR1113716
FEATURES
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NAMES
    SMILES
    CCOc1ccc(-c2ccc(C(=O)O)cc2C)cc1CNC(=O)c1ccc(C(F)(F)F)cc1
    InChI
    InChI=1S/C25H22F3NO4/c1-3-33-22-11-7-17(21-10-6-18(24(31)32)12-15(21)2)13-19(22)14-29-23(30)16-4-8-20(9-5-16)25(26,27)28/h4-13H,3,14H2,1-2H3,(H,29,30)(H,31,32)
    MOLECULAR FORMULA
    C25H22F3NO4
    CROSS REFERENCES
    1113716 logo

    canSAR1113716

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.15
    AlogP 5.71
    HBond donors 2
    HBond acceptors 5
    Atoms 55
    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 canSAR1113716.