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canSAR1596754
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NAMES
    SMILES
    O=C(NC1CCCCCC1)C(=S)NCCc1ccccc1
    InChI
    InChI=1S/C17H24N2OS/c20-16(19-15-10-6-1-2-7-11-15)17(21)18-13-12-14-8-4-3-5-9-14/h3-5,8-9,15H,1-2,6-7,10-13H2,(H,18,21)(H,19,20)
    MOLECULAR FORMULA
    C17H24N2OS
    CROSS REFERENCES
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    canSAR1596754

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 304.16
    AlogP 2.99
    HBond donors 2
    HBond acceptors 3
    Atoms 45
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1596754.