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canSAR1508404
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(O)c(Nc2c([N+](=O)[O-])ccc3nonc23)c1
    InChI
    InChI=1S/C12H7N5O6/c18-10-4-1-6(16(19)20)5-8(10)13-12-9(17(21)22)3-2-7-11(12)15-23-14-7/h1-5,13,18H
    MOLECULAR FORMULA
    C12H7N5O6
    CROSS REFERENCES
    1508404 logo

    canSAR1508404

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 317.04
    AlogP 2.49
    HBond donors 2
    HBond acceptors 11
    Atoms 30
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1508404.