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canSAR1529835
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NAMES
    SMILES
    CSc1ccc(Cn2c(C)c(C(=O)NCc3cccc(Cl)c3)sc2=O)cc1
    InChI
    InChI=1S/C20H19ClN2O2S2/c1-13-18(19(24)22-11-15-4-3-5-16(21)10-15)27-20(25)23(13)12-14-6-8-17(26-2)9-7-14/h3-10H,11-12H2,1-2H3,(H,22,24)
    MOLECULAR FORMULA
    C20H19ClN2O2S2
    CROSS REFERENCES
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    canSAR1529835

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.06
    AlogP 4.57
    HBond donors 1
    HBond acceptors 4
    Atoms 46
    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 canSAR1529835.