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canSAR354515
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NAMES
    SMILES
    COCOc1c(-c2ccccc2)cccc1-c1ccc(C(=O)OCC(C)CC(C)(C)C)cc1
    InChI
    InChI=1S/C29H34O4/c1-21(18-29(2,3)4)19-32-28(30)24-16-14-23(15-17-24)26-13-9-12-25(27(26)33-20-31-5)22-10-7-6-8-11-22/h6-17,21H,18-20H2,1-5H3
    MOLECULAR FORMULA
    C29H34O4
    CROSS REFERENCES
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    canSAR354515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.25
    AlogP 7.23
    HBond donors 0
    HBond acceptors 4
    Atoms 67
    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 canSAR354515.