canSAR384550
FEATURES
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NAMES
    SMILES
    NC[C@@H]1C[C@@]1(C(=O)N1CCc2ccccc2C1)c1ccc2c(c1)OCO2
    InChI
    InChI=1S/C21H22N2O3/c22-11-17-10-21(17,16-5-6-18-19(9-16)26-13-25-18)20(24)23-8-7-14-3-1-2-4-15(14)12-23/h1-6,9,17H,7-8,10-13,22H2/t17-,21+/m0/s1
    MOLECULAR FORMULA
    C21H22N2O3
    CROSS REFERENCES
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    canSAR384550
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight350.16
    AlogP2.22
    HBond donors2
    HBond acceptors5
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR384550.