canSAR1085046
FEATURES
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NAMES
    SMILES
    CSCCNC(=O)C1CCN(c2nc3cc(Cl)ccc3o2)CC1
    InChI
    InChI=1S/C16H20ClN3O2S/c1-23-9-6-18-15(21)11-4-7-20(8-5-11)16-19-13-10-12(17)2-3-14(13)22-16/h2-3,10-11H,4-9H2,1H3,(H,18,21)
    MOLECULAR FORMULA
    C16H20ClN3O2S
    CROSS REFERENCES
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    canSAR1085046
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight353.10
    AlogP3.18
    HBond donors1
    HBond acceptors5
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1085046.