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canSAR1999576
FEATURES
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NAMES
    SMILES
    COc1cccc(NC(=O)COC(=O)COc2ccccc2[N+](=O)[O-])c1
    InChI
    InChI=1S/C17H16N2O7/c1-24-13-6-4-5-12(9-13)18-16(20)10-26-17(21)11-25-15-8-3-2-7-14(15)19(22)23/h2-9H,10-11H2,1H3,(H,18,20)
    MOLECULAR FORMULA
    C17H16N2O7
    CROSS REFERENCES
    1999576 logo

    canSAR1999576

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.10
    AlogP 2.16
    HBond donors 1
    HBond acceptors 9
    Atoms 42
    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 canSAR1999576.