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canSAR1490414
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NAMES
    SMILES
    CCOC(=O)c1cc(-c2ccccc2)n(-c2cccc(C(=O)Nc3cccc(C(C)=O)c3)c2)c1C
    InChI
    InChI=1S/C29H26N2O4/c1-4-35-29(34)26-18-27(21-10-6-5-7-11-21)31(19(26)2)25-15-9-13-23(17-25)28(33)30-24-14-8-12-22(16-24)20(3)32/h5-18H,4H2,1-3H3,(H,30,33)
    MOLECULAR FORMULA
    C29H26N2O4
    CROSS REFERENCES
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    canSAR1490414

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.19
    AlogP 6.08
    HBond donors 1
    HBond acceptors 6
    Atoms 61
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1490414.