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canSAR1012636
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NAMES
    SMILES
    COc1cc(C(=O)c2ccc3c(I)c(OC)ccc3n2)cc(OC)c1OC
    InChI
    InChI=1S/C20H18INO5/c1-24-15-8-7-13-12(18(15)21)5-6-14(22-13)19(23)11-9-16(25-2)20(27-4)17(10-11)26-3/h5-10H,1-4H3
    MOLECULAR FORMULA
    C20H18INO5
    CROSS REFERENCES
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    canSAR1012636

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.02
    AlogP 4.10
    HBond donors 0
    HBond acceptors 6
    Atoms 45
    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 canSAR1012636.