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canSAR1971605
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(O)c(C(C#Cc2ccccc2)N2CCOCC2)c1
    InChI
    InChI=1S/C19H18N2O4/c22-19-9-7-16(21(23)24)14-17(19)18(20-10-12-25-13-11-20)8-6-15-4-2-1-3-5-15/h1-5,7,9,14,18,22H,10-13H2
    MOLECULAR FORMULA
    C19H18N2O4
    CROSS REFERENCES
    1971605 logo

    canSAR1971605

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.13
    AlogP 2.73
    HBond donors 1
    HBond acceptors 6
    Atoms 43
    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 canSAR1971605.