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canSAR552369
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NAMES
    SMILES
    CC(C)Oc1ccccc1N1CCN(Cc2cccc(CN3CCCCC3=O)n2)CC1.Cl
    InChI
    InChI=1S/C25H34N4O2.ClH/c1-20(2)31-24-11-4-3-10-23(24)28-16-14-27(15-17-28)18-21-8-7-9-22(26-21)19-29-13-6-5-12-25(29)30;/h3-4,7-11,20H,5-6,12-19H2,1-2H3;1H
    MOLECULAR FORMULA
    C25H35ClN4O2
    CROSS REFERENCES
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    canSAR552369

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.24
    AlogP 4.13
    HBond donors 0
    HBond acceptors 6
    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 canSAR552369.