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canSAR1402112
FEATURES
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NAMES
    SMILES
    CC(=NNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccco1
    InChI
    InChI=1S/C13H10N4O6/c1-8(12-3-2-4-23-12)14-15-13(18)9-5-10(16(19)20)7-11(6-9)17(21)22/h2-7H,1H3,(H,15,18)
    MOLECULAR FORMULA
    C13H10N4O6
    CROSS REFERENCES
    1402112 logo

    canSAR1402112

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 318.06
    AlogP 2.25
    HBond donors 1
    HBond acceptors 10
    Atoms 33
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1402112.