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canSAR1721128
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NAMES
    SMILES
    COc1cc(-c2cccs2)cc(C2NCCS2)c1O
    InChI
    InChI=1S/C14H15NO2S2/c1-17-11-8-9(12-3-2-5-18-12)7-10(13(11)16)14-15-4-6-19-14/h2-3,5,7-8,14-16H,4,6H2,1H3
    MOLECULAR FORMULA
    C14H15NO2S2
    CROSS REFERENCES
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    canSAR1721128

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 293.05
    AlogP 3.46
    HBond donors 2
    HBond acceptors 3
    Atoms 34
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1721128.