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canSAR65214
FEATURES
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NAMES
    SMILES
    CC1=C(CO)/C(=N/Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1
    InChI
    InChI=1S/C13H14N4O5/c1-8-2-4-11(10(8)7-18)14-15-12-5-3-9(16(19)20)6-13(12)17(21)22/h3,5-6,15,18H,2,4,7H2,1H3/b14-11+
    MOLECULAR FORMULA
    C13H14N4O5
    CROSS REFERENCES
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    canSAR65214

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 306.10
    AlogP 2.37
    HBond donors 2
    HBond acceptors 9
    Atoms 36
    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 canSAR65214.