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canSAR353728
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NAMES
    SMILES
    Cc1ccc[n+](C2=C([O-])C(=O)c3c(O)ccc(O)c3C2=O)c1
    InChI
    InChI=1S/C16H11NO5/c1-8-3-2-6-17(7-8)13-14(20)11-9(18)4-5-10(19)12(11)15(21)16(13)22/h2-7H,1H3,(H2-,18,19,20,21,22)
    MOLECULAR FORMULA
    C16H11NO5
    CROSS REFERENCES
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    canSAR353728

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.06
    AlogP 0.30
    HBond donors 2
    HBond acceptors 6
    Atoms 33
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR353728.