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canSAR1153065
FEATURES
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NAMES
    SMILES
    Cn1cc(C(=O)NCC#N)c(OS(C)(=O)=O)n1
    InChI
    InChI=1S/C8H10N4O4S/c1-12-5-6(7(13)10-4-3-9)8(11-12)16-17(2,14)15/h5H,4H2,1-2H3,(H,10,13)
    MOLECULAR FORMULA
    C8H10N4O4S
    CROSS REFERENCES
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    canSAR1153065

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 258.04
    AlogP -0.99
    HBond donors 1
    HBond acceptors 8
    Atoms 27
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1153065.