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canSAR1688524
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NAMES
    SMILES
    COc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCCC3)n2)cc1
    InChI
    InChI=1S/C15H18N6O3/c1-24-11-6-4-10(5-7-11)17-15-18-13(16)12(21(22)23)14(19-15)20-8-2-3-9-20/h4-7H,2-3,8-9H2,1H3,(H3,16,17,18,19)
    MOLECULAR FORMULA
    C15H18N6O3
    CROSS REFERENCES
    1688524 logo

    canSAR1688524

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.14
    AlogP 2.32
    HBond donors 3
    HBond acceptors 9
    Atoms 42
    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 canSAR1688524.