canSAR414402
FEATURES
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NAMES
    SMILES
    O=C1c2ccccc2SC(O)(c2ccccc2)C2CCCN12
    InChI
    InChI=1S/C18H17NO2S/c20-17-14-9-4-5-10-15(14)22-18(21,13-7-2-1-3-8-13)16-11-6-12-19(16)17/h1-5,7-10,16,21H,6,11-12H2
    MOLECULAR FORMULA
    C18H17NO2S
    CROSS REFERENCES
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    canSAR414402
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight311.10
    AlogP3.24
    HBond donors1
    HBond acceptors3
    Atoms39
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR414402.