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canSAR1831761
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NAMES
    SMILES
    CC(C)Oc1ccc(CNC(=O)c2ccc(C[S+]([O-])c3cccc(Cl)c3)o2)cc1
    InChI
    InChI=1S/C22H22ClNO4S/c1-15(2)27-18-8-6-16(7-9-18)13-24-22(25)21-11-10-19(28-21)14-29(26)20-5-3-4-17(23)12-20/h3-12,15H,13-14H2,1-2H3,(H,24,25)
    MOLECULAR FORMULA
    C22H22ClNO4S
    CROSS REFERENCES
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    canSAR1831761

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.10
    AlogP 4.96
    HBond donors 1
    HBond acceptors 5
    Atoms 51
    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 canSAR1831761.