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canSAR1093873
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NAMES
    SMILES
    OC12C3C4CC5C6C4C1C6C(C53)N2Cc1ccc(I)cc1
    InChI
    InChI=1S/C18H18INO/c19-8-3-1-7(2-4-8)6-20-17-13-9-5-10-12-11(9)14(17)16(12)18(20,21)15(10)13/h1-4,9-17,21H,5-6H2
    MOLECULAR FORMULA
    C18H18INO
    CROSS REFERENCES
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    canSAR1093873

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.04
    AlogP 2.55
    HBond donors 1
    HBond acceptors 2
    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 canSAR1093873.