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canSAR2018107
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NAMES
    SMILES
    CC(C)(C)c1nc(SCC(=O)c2ccccc2)c2ccccc2n1
    InChI
    InChI=1S/C20H20N2OS/c1-20(2,3)19-21-16-12-8-7-11-15(16)18(22-19)24-13-17(23)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3
    MOLECULAR FORMULA
    C20H20N2OS
    CROSS REFERENCES
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    canSAR2018107

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 336.13
    AlogP 4.90
    HBond donors 0
    HBond acceptors 3
    Atoms 44
    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 canSAR2018107.