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canSAR227895
FEATURES
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NAMES
    SMILES
    CCN1CCc2c([n+]([O-])c3ccccc3[n+]2[O-])C1=O
    InChI
    InChI=1S/C13H13N3O3/c1-2-14-8-7-11-12(13(14)17)16(19)10-6-4-3-5-9(10)15(11)18/h3-6H,2,7-8H2,1H3
    MOLECULAR FORMULA
    C13H13N3O3
    CROSS REFERENCES
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    canSAR227895

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 259.10
    AlogP 0.12
    HBond donors 0
    HBond acceptors 6
    Atoms 32
    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 canSAR227895.