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canSAR652576
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NAMES
    SMILES
    CN1CCN(c2nc(N)c3c(n2)C(=O)C(c2ccccc2)=[N+]3[O-])CC1
    InChI
    InChI=1S/C17H18N6O2/c1-21-7-9-22(10-8-21)17-19-12-14(16(18)20-17)23(25)13(15(12)24)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,18,19,20)
    MOLECULAR FORMULA
    C17H18N6O2
    CROSS REFERENCES
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    canSAR652576

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.15
    AlogP 0.64
    HBond donors 2
    HBond acceptors 8
    Atoms 43
    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 canSAR652576.