canSAR859734
FEATURES
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NAMES
    SMILES
    COCCN/C(=C/c1ccc2ccccc2[n+]1C)SC.[I-]
    InChI
    InChI=1S/C16H20N2OS.HI/c1-18-14(12-16(20-3)17-10-11-19-2)9-8-13-6-4-5-7-15(13)18;/h4-9,12H,10-11H2,1-3H3;1H
    MOLECULAR FORMULA
    C16H21IN2OS
    CROSS REFERENCES
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    canSAR859734
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight416.04
    AlogP-0.43
    HBond donors1
    HBond acceptors3
    Atoms42
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR859734.