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canSAR2001949
FEATURES
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NAMES
    SMILES
    O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]
    InChI
    InChI=1S/C26H21NO6/c28-22-10-6-19(7-11-22)8-12-23(29)17-24(30)13-9-21-16-25(14-15-26(21)27(31)32)33-18-20-4-2-1-3-5-20/h1-16,28H,17-18H2/b12-8+,13-9+
    MOLECULAR FORMULA
    C26H21NO6
    CROSS REFERENCES
    2001949 logo

    canSAR2001949

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.14
    AlogP 5.13
    HBond donors 1
    HBond acceptors 7
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2001949.