canSAR1085322
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCSC1=CC(=O)c2ccccc2C1=O
    InChI
    InChI=1S/C21H28O2S/c1-2-3-4-5-6-7-8-9-12-15-24-20-16-19(22)17-13-10-11-14-18(17)21(20)23/h10-11,13-14,16H,2-9,12,15H2,1H3
    MOLECULAR FORMULA
    C21H28O2S
    CROSS REFERENCES
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    canSAR1085322
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight344.18
    AlogP6.21
    HBond donors0
    HBond acceptors2
    Atoms52
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1085322.