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canSAR563721
FEATURES
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NAMES
    SMILES
    CC(C)c1nc(-c2ccccc2)cc(-c2ccc(F)cc2)c1/C=C/P(=O)(O)C[C@H](O)CC(=O)O
    InChI
    InChI=1S/C26H27FNO5P/c1-17(2)26-22(12-13-34(32,33)16-21(29)14-25(30)31)23(18-8-10-20(27)11-9-18)15-24(28-26)19-6-4-3-5-7-19/h3-13,15,17,21,29H,14,16H2,1-2H3,(H,30,31)(H,32,33)/b13-12+/t21-/m1/s1
    MOLECULAR FORMULA
    C26H27FNO5P
    CROSS REFERENCES
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    canSAR563721

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 483.16
    AlogP 5.75
    HBond donors 3
    HBond acceptors 6
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR563721.