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canSAR1830861
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NAMES
    SMILES
    COc1cc2c(cc1OC)C(c1ccccc1[N+](=O)[O-])N(C(C)=O)CC2
    InChI
    InChI=1S/C19H20N2O5/c1-12(22)20-9-8-13-10-17(25-2)18(26-3)11-15(13)19(20)14-6-4-5-7-16(14)21(23)24/h4-7,10-11,19H,8-9H2,1-3H3
    MOLECULAR FORMULA
    C19H20N2O5
    CROSS REFERENCES
    1830861 logo

    canSAR1830861

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 356.14
    AlogP 3.11
    HBond donors 0
    HBond acceptors 7
    Atoms 46
    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 canSAR1830861.