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canSAR1864585
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NAMES
    SMILES
    CCc1ccc2c(CN3CCN(S(=O)(=O)c4cccs4)CC3)cc(=O)oc2c1
    InChI
    InChI=1S/C20H22N2O4S2/c1-2-15-5-6-17-16(13-19(23)26-18(17)12-15)14-21-7-9-22(10-8-21)28(24,25)20-4-3-11-27-20/h3-6,11-13H,2,7-10,14H2,1H3
    MOLECULAR FORMULA
    C20H22N2O4S2
    CROSS REFERENCES
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    canSAR1864585

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.10
    AlogP 2.92
    HBond donors 0
    HBond acceptors 6
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1864585.