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canSAR782974
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NAMES
    SMILES
    COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CCCCN1Cc1ccccc1
    InChI
    InChI=1S/C21H23Cl2NO2/c1-26-21(25)20(16-10-11-17(22)18(23)13-16)19-9-5-6-12-24(19)14-15-7-3-2-4-8-15/h2-4,7-8,10-11,13,19-20H,5-6,9,12,14H2,1H3/t19-,20-/m1/s1
    MOLECULAR FORMULA
    C21H23Cl2NO2
    CROSS REFERENCES
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    canSAR782974

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.11
    AlogP 5.30
    HBond donors 0
    HBond acceptors 3
    Atoms 49
    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 canSAR782974.