canSAR539105
FEATURES
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NAMES
    SMILES
    Cc1cc(C)c(OCC(O)C[C@@H](O)CC(=O)[O-])c(C(c2ccc(F)cc2)c2cccc(C(F)(F)F)c2)c1
    InChI
    InChI=1S/C28H28F4O5/c1-16-10-17(2)27(37-15-23(34)13-22(33)14-25(35)36)24(11-16)26(18-6-8-21(29)9-7-18)19-4-3-5-20(12-19)28(30,31)32/h3-12,22-23,26,33-34H,13-15H2,1-2H3,(H,35,36)/p-1/t22-,23?,26?/m1/s1
    MOLECULAR FORMULA
    C28H27F4O5-
    CROSS REFERENCES
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    canSAR539105
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight519.18
    AlogP4.27
    HBond donors2
    HBond acceptors5
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR539105.