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canSAR1115728
FEATURES
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NAMES
    SMILES
    Cc1ccc2c(c1)[n+]([O-])c(C#N)c(NC(=O)c1ccc([N+](=O)[O-])o1)[n+]2[O-]
    InChI
    InChI=1S/C15H9N5O6/c1-8-2-3-9-10(6-8)18(22)11(7-16)14(19(9)23)17-15(21)12-4-5-13(26-12)20(24)25/h2-6H,1H3,(H,17,21)
    MOLECULAR FORMULA
    C15H9N5O6
    CROSS REFERENCES
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    canSAR1115728

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.06
    AlogP 1.04
    HBond donors 1
    HBond acceptors 11
    Atoms 35
    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 canSAR1115728.