canSAR1846380
FEATURES
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NAMES
    SMILES
    C#CCOc1ccc(C2C3=C(CC(C)(C)CC3=O)N(CC(=O)O)C3=C2C(=O)CC(C)(C)C3)cc1
    InChI
    InChI=1S/C28H31NO5/c1-6-11-34-18-9-7-17(8-10-18)24-25-19(12-27(2,3)14-21(25)30)29(16-23(32)33)20-13-28(4,5)15-22(31)26(20)24/h1,7-10,24H,11-16H2,2-5H3,(H,32,33)
    MOLECULAR FORMULA
    C28H31NO5
    CROSS REFERENCES
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    canSAR1846380
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight461.22
    AlogP4.47
    HBond donors1
    HBond acceptors6
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846380.