canSAR869800
FEATURES
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NAMES
    SMILES
    COc1ccc([C@H]2[C@H]([C@H](O)CCc3ccccc3)C(=O)N2c2ccccc2)cc1
    InChI
    InChI=1S/C25H25NO3/c1-29-21-15-13-19(14-16-21)24-23(22(27)17-12-18-8-4-2-5-9-18)25(28)26(24)20-10-6-3-7-11-20/h2-11,13-16,22-24,27H,12,17H2,1H3/t22-,23+,24+/m1/s1
    MOLECULAR FORMULA
    C25H25NO3
    CROSS REFERENCES
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    canSAR869800
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight387.18
    AlogP4.39
    HBond donors1
    HBond acceptors4
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR869800.