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canSAR1965442
FEATURES
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NAMES
    SMILES
    COCCNC(C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1
    InChI
    InChI=1S/C17H18BrN3O4/c1-25-10-9-19-16(12-5-3-2-4-6-12)17(22)20-15-8-7-13(21(23)24)11-14(15)18/h2-8,11,16,19H,9-10H2,1H3,(H,20,22)
    MOLECULAR FORMULA
    C17H18BrN3O4
    CROSS REFERENCES
    1965442 logo

    canSAR1965442

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.05
    AlogP 3.27
    HBond donors 2
    HBond acceptors 7
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1965442.