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canSAR1523147
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NAMES
    SMILES
    Nc1nc2ncnc-2c[nH]1.O=[N+]([O-])O
    InChI
    InChI=1S/C5H5N5.HNO3/c6-5-7-1-3-4(10-5)9-2-8-3;2-1(3)4/h1-2H,(H3,6,7,8,9,10);(H,2,3,4)
    MOLECULAR FORMULA
    C5H6N6O3
    CROSS REFERENCES
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    canSAR1523147

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 198.05
    AlogP -0.46
    HBond donors 4
    HBond acceptors 9
    Atoms 20
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1523147.