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canSAR106145
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NAMES
    SMILES
    CC(=O)NC(C)C#Cc1cnc(Oc2ccc(SC(C)C)cc2)s1
    InChI
    InChI=1S/C18H20N2O2S2/c1-12(2)23-16-9-6-15(7-10-16)22-18-19-11-17(24-18)8-5-13(3)20-14(4)21/h6-7,9-13H,1-4H3,(H,20,21)
    MOLECULAR FORMULA
    C18H20N2O2S2
    CROSS REFERENCES
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    canSAR106145

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.10
    AlogP 4.31
    HBond donors 1
    HBond acceptors 4
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR106145.