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canSAR843182
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@@H]3c4cc(I)c(OS(N)(=O)=O)cc4CC[C@H]3[C@@H]1CCC2=O
    InChI
    InChI=1S/C18H22INO4S/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-16(24-25(20,22)23)15(19)9-13(10)11/h8-9,11-12,14H,2-7H2,1H3,(H2,20,22,23)/t11-,12+,14-,18-/m0/s1
    MOLECULAR FORMULA
    C18H22INO4S
    CROSS REFERENCES
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    canSAR843182

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.03
    AlogP 3.30
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    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 canSAR843182.