canSAR1932007
FEATURES
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NAMES
    SMILES
    O=C(COC(=O)c1cc[n+]([O-])cc1)Nc1ccc2c(c1)OCCO2
    InChI
    InChI=1S/C16H14N2O6/c19-15(10-24-16(20)11-3-5-18(21)6-4-11)17-12-1-2-13-14(9-12)23-8-7-22-13/h1-6,9H,7-8,10H2,(H,17,19)
    MOLECULAR FORMULA
    C16H14N2O6
    CROSS REFERENCES
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    canSAR1932007
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight330.09
    AlogP0.89
    HBond donors1
    HBond acceptors8
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932007.