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canSAR1524725
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NAMES
    SMILES
    O=S(=O)(O)c1ccc(/N=N/c2ccc3c(S(=O)(=O)O)cccc3c2O)c2ccccc12.[Na+]
    InChI
    InChI=1S/C20H14N2O7S2.Na/c23-20-15-6-3-7-18(30(24,25)26)14(15)8-9-17(20)22-21-16-10-11-19(31(27,28)29)13-5-2-1-4-12(13)16;/h1-11,23H,(H,24,25,26)(H,27,28,29);/q;+1/b22-21+;
    MOLECULAR FORMULA
    C20H14N2NaO7S2+
    CROSS REFERENCES
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    canSAR1524725

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 481.01
    AlogP 1.61
    HBond donors 3
    HBond acceptors 9
    Atoms 46
    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 canSAR1524725.