canSAR1774680
FEATURES
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NAMES
    SMILES
    CC(C)=CCOc1ccc(C2=C(CC(C)C)C(=O)N(C(c3ccccc3)C(O)C(=O)O)C2=O)cc1
    InChI
    InChI=1S/C28H31NO6/c1-17(2)14-15-35-21-12-10-19(11-13-21)23-22(16-18(3)4)26(31)29(27(23)32)24(25(30)28(33)34)20-8-6-5-7-9-20/h5-14,18,24-25,30H,15-16H2,1-4H3,(H,33,34)
    MOLECULAR FORMULA
    C28H31NO6
    CROSS REFERENCES
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    canSAR1774680
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight477.22
    AlogP4.39
    HBond donors2
    HBond acceptors7
    Atoms66
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1774680.