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canSAR1067359
FEATURES
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NAMES
    SMILES
    COc1ccc2c(c1OCCO[N+](=O)[O-])COC(C)C2=O
    InChI
    InChI=1S/C13H15NO7/c1-8-12(15)9-3-4-11(18-2)13(10(9)7-20-8)19-5-6-21-14(16)17/h3-4,8H,5-7H2,1-2H3
    MOLECULAR FORMULA
    C13H15NO7
    CROSS REFERENCES
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    canSAR1067359

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.08
    AlogP 1.38
    HBond donors 0
    HBond acceptors 8
    Atoms 36
    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 canSAR1067359.