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canSAR842825
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NAMES
    SMILES
    CCCCN1CCC[C@@H](c2cccc(C#N)c2)C1
    InChI
    InChI=1S/C16H22N2/c1-2-3-9-18-10-5-8-16(13-18)15-7-4-6-14(11-15)12-17/h4,6-7,11,16H,2-3,5,8-10,13H2,1H3/t16-/m1/s1
    MOLECULAR FORMULA
    C16H22N2
    CROSS REFERENCES
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    canSAR842825

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 242.18
    AlogP 3.54
    HBond donors 0
    HBond acceptors 2
    Atoms 40
    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 canSAR842825.