canSAR1089683
FEATURES
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NAMES
    SMILES
    CS(=O)(=O)CCCOc1cccc(C#Cc2ccc(CCC(=O)O)cc2)c1
    InChI
    InChI=1S/C21H22O5S/c1-27(24,25)15-3-14-26-20-5-2-4-19(16-20)11-10-17-6-8-18(9-7-17)12-13-21(22)23/h2,4-9,16H,3,12-15H2,1H3,(H,22,23)
    MOLECULAR FORMULA
    C21H22O5S
    CROSS REFERENCES
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    canSAR1089683
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight386.12
    AlogP2.92
    HBond donors1
    HBond acceptors5
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1089683.