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canSAR652287
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NAMES
    SMILES
    O=C(CC(c1ccccc1)c1ccccc1)N1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1
    InChI
    InChI=1S/C32H31ClN2O/c33-29-18-16-28(17-19-29)32(27-14-8-3-9-15-27)35-22-20-34(21-23-35)31(36)24-30(25-10-4-1-5-11-25)26-12-6-2-7-13-26/h1-19,30,32H,20-24H2/t32-/m0/s1
    MOLECULAR FORMULA
    C32H31ClN2O
    CROSS REFERENCES
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    canSAR652287

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 494.21
    AlogP 6.80
    HBond donors 0
    HBond acceptors 3
    Atoms 67
    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 canSAR652287.