canSAR1417614
FEATURES
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NAMES
    SMILES
    C#CC1(NC(=O)NCCCC)CCCCC1
    InChI
    InChI=1S/C13H22N2O/c1-3-5-11-14-12(16)15-13(4-2)9-7-6-8-10-13/h2H,3,5-11H2,1H3,(H2,14,15,16)
    MOLECULAR FORMULA
    C13H22N2O
    CROSS REFERENCES
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    canSAR1417614
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight222.17
    AlogP2.42
    HBond donors2
    HBond acceptors3
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417614.