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canSAR112822
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NAMES
    SMILES
    CC1(C)C=Cc2c(I)cc3oc(=O)cc(-c4ccccc4)c3c2O1
    InChI
    InChI=1S/C20H15IO3/c1-20(2)9-8-13-15(21)11-16-18(19(13)24-20)14(10-17(22)23-16)12-6-4-3-5-7-12/h3-11H,1-2H3
    MOLECULAR FORMULA
    C20H15IO3
    CROSS REFERENCES
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    canSAR112822

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.01
    AlogP 5.25
    HBond donors 0
    HBond acceptors 3
    Atoms 39
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR112822.