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canSAR1130244
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NAMES
    SMILES
    O=C(C=Cc1cn(Cc2ccccc2)c2ccccc12)CC(=O)C(=O)O
    InChI
    InChI=1S/C21H17NO4/c23-17(12-20(24)21(25)26)11-10-16-14-22(13-15-6-2-1-3-7-15)19-9-5-4-8-18(16)19/h1-11,14H,12-13H2,(H,25,26)
    MOLECULAR FORMULA
    C21H17NO4
    CROSS REFERENCES
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    canSAR1130244

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.12
    AlogP 3.32
    HBond donors 1
    HBond acceptors 5
    Atoms 43
    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 canSAR1130244.