canSAR1846789
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OC)C1OC(CCCCN3C(=O)c4ccccc4C3=O)(C2)OC2=C1C(=O)OC1(CCCCC1)C2
    InChI
    InChI=1S/C33H35NO8/c1-38-24-16-20-18-33(14-8-9-15-34-29(35)21-10-4-5-11-22(21)30(34)36)40-26-19-32(12-6-3-7-13-32)42-31(37)27(26)28(41-33)23(20)17-25(24)39-2/h4-5,10-11,16-17,28H,3,6-9,12-15,18-19H2,1-2H3
    MOLECULAR FORMULA
    C33H35NO8
    CROSS REFERENCES
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    canSAR1846789
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight573.24
    AlogP5.41
    HBond donors0
    HBond acceptors9
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846789.