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canSAR1142580
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NAMES
    SMILES
    Cc1[nH]c2ccccc2c1CC(=O)N1CCN(C(=O)c2ccccc2C(=O)c2ccc(Cl)cc2)CC1
    InChI
    InChI=1S/C29H26ClN3O3/c1-19-25(22-6-4-5-9-26(22)31-19)18-27(34)32-14-16-33(17-15-32)29(36)24-8-3-2-7-23(24)28(35)20-10-12-21(30)13-11-20/h2-13,31H,14-18H2,1H3
    MOLECULAR FORMULA
    C29H26ClN3O3
    CROSS REFERENCES
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    canSAR1142580

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.17
    AlogP 4.89
    HBond donors 1
    HBond acceptors 6
    Atoms 62
    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 canSAR1142580.