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canSAR1441450
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NAMES
    SMILES
    N[C@@H]1CCN(CCCOc2ccc(-c3nc4ccc(Oc5ccc(Cl)cc5)cc4o3)cc2)C1
    InChI
    InChI=1S/C26H26ClN3O3/c27-19-4-8-22(9-5-19)32-23-10-11-24-25(16-23)33-26(29-24)18-2-6-21(7-3-18)31-15-1-13-30-14-12-20(28)17-30/h2-11,16,20H,1,12-15,17,28H2/t20-/m1/s1
    MOLECULAR FORMULA
    C26H26ClN3O3
    CROSS REFERENCES
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    canSAR1441450

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.17
    AlogP 5.74
    HBond donors 2
    HBond acceptors 6
    Atoms 59
    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 canSAR1441450.