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canSAR2017669
FEATURES
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NAMES
    SMILES
    CCCC(=O)N1CCN(c2ccc(NC(=O)c3ccc(OCC)c([N+](=O)[O-])c3)cc2)CC1
    InChI
    InChI=1S/C23H28N4O5/c1-3-5-22(28)26-14-12-25(13-15-26)19-9-7-18(8-10-19)24-23(29)17-6-11-21(32-4-2)20(16-17)27(30)31/h6-11,16H,3-5,12-15H2,1-2H3,(H,24,29)
    MOLECULAR FORMULA
    C23H28N4O5
    CROSS REFERENCES
    2017669 logo

    canSAR2017669

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.21
    AlogP 3.69
    HBond donors 1
    HBond acceptors 9
    Atoms 60
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2017669.