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canSAR732672
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NAMES
    SMILES
    COc1ccc(/C=C/c2cc(OC)c(CCCCCCCCCCCCO)c(OC)c2)cc1
    InChI
    InChI=1S/C29H42O4/c1-31-26-19-17-24(18-20-26)15-16-25-22-28(32-2)27(29(23-25)33-3)14-12-10-8-6-4-5-7-9-11-13-21-30/h15-20,22-23,30H,4-14,21H2,1-3H3/b16-15+
    MOLECULAR FORMULA
    C29H42O4
    CROSS REFERENCES
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    canSAR732672

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.31
    AlogP 7.32
    HBond donors 1
    HBond acceptors 4
    Atoms 75
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR732672.