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canSAR1442293
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)ccc1OCC(=O)O
    InChI
    InChI=1S/C20H16N2O6/c1-27-19-11-13(6-10-18(19)28-12-20(23)24)5-7-14-8-9-15-16(21-14)3-2-4-17(15)22(25)26/h2-11H,12H2,1H3,(H,23,24)/b7-5+
    MOLECULAR FORMULA
    C20H16N2O6
    CROSS REFERENCES
    1442293 logo

    canSAR1442293

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.10
    AlogP 3.79
    HBond donors 1
    HBond acceptors 8
    Atoms 44
    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 canSAR1442293.