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canSAR83358
FEATURES
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NAMES
    SMILES
    NCc1ccc(Cl)cc1CNC(=O)CNC(=O)C(CCc1cccc[n+]1[O-])NC(=O)C(=O)O
    InChI
    InChI=1S/C21H24ClN5O6/c22-15-5-4-13(10-23)14(9-15)11-24-18(28)12-25-19(29)17(26-20(30)21(31)32)7-6-16-3-1-2-8-27(16)33/h1-5,8-9,17H,6-7,10-12,23H2,(H,24,28)(H,25,29)(H,26,30)(H,31,32)
    MOLECULAR FORMULA
    C21H24ClN5O6
    CROSS REFERENCES
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    canSAR83358

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.14
    AlogP -0.63
    HBond donors 6
    HBond acceptors 11
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR83358.