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canSAR559409
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NAMES
    SMILES
    Nc1c(CC(=O)O)cccc1C(=O)c1ccc(-c2ccccc2)cc1
    InChI
    InChI=1S/C21H17NO3/c22-20-17(13-19(23)24)7-4-8-18(20)21(25)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-12H,13,22H2,(H,23,24)
    MOLECULAR FORMULA
    C21H17NO3
    CROSS REFERENCES
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    canSAR559409

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.12
    AlogP 3.79
    HBond donors 3
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR559409.