canSAR2079977
FEATURES
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NAMES
    SMILES
    O[C@H](CN1CC(Cc2cccc(OC(F)(F)F)c2)(c2ccccc2)c2cc(OC(F)(F)F)ccc21)C(F)(F)F
    InChI
    InChI=1S/C26H20F9NO3/c27-24(28,29)22(37)14-36-15-23(17-6-2-1-3-7-17,13-16-5-4-8-18(11-16)38-25(30,31)32)20-12-19(9-10-21(20)36)39-26(33,34)35/h1-12,22,37H,13-15H2/t22-,23?/m1/s1
    MOLECULAR FORMULA
    C26H20F9NO3
    CROSS REFERENCES
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    canSAR2079977
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight565.13
    AlogP6.76
    HBond donors1
    HBond acceptors4
    Atoms59
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2079977.