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canSAR1997939
FEATURES
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NAMES
    SMILES
    COc1ccccc1-c1cc(-c2ccccc2)nc(SCC(=O)O)c1C#N
    InChI
    InChI=1S/C21H16N2O3S/c1-26-19-10-6-5-9-15(19)16-11-18(14-7-3-2-4-8-14)23-21(17(16)12-22)27-13-20(24)25/h2-11H,13H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C21H16N2O3S
    CROSS REFERENCES
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    canSAR1997939

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.09
    AlogP 4.47
    HBond donors 1
    HBond acceptors 5
    Atoms 43
    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 canSAR1997939.