canSAR856972
FEATURES
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NAMES
    SMILES
    CNCCCCOc1ccccc1[S+]([O-])c1ccccc1.Cl
    InChI
    InChI=1S/C17H21NO2S.ClH/c1-18-13-7-8-14-20-16-11-5-6-12-17(16)21(19)15-9-3-2-4-10-15;/h2-6,9-12,18H,7-8,13-14H2,1H3;1H
    MOLECULAR FORMULA
    C17H22ClNO2S
    CROSS REFERENCES
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    canSAR856972
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight339.11
    AlogP3.65
    HBond donors1
    HBond acceptors3
    Atoms44
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856972.