canSAR2096275
FEATURES
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NAMES
    SMILES
    c1ccc(CC2CCN(C[C@H]3CO[C@@](c4ccccc4)(C4CCCCC4)O3)CC2)cc1
    InChI
    InChI=1S/C28H37NO2/c1-4-10-23(11-5-1)20-24-16-18-29(19-17-24)21-27-22-30-28(31-27,25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1-2,4-7,10-13,24,26-27H,3,8-9,14-22H2/t27-,28+/m0/s1
    MOLECULAR FORMULA
    C28H37NO2
    CROSS REFERENCES
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    canSAR2096275
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.28
    AlogP5.79
    HBond donors0
    HBond acceptors3
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096275.