canSAR2203749
FEATURES
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NAMES
    SMILES
    CCO[C@@H](Cc1ccc(OCCc2ccc(OS(C)(=O)=O)cc2)cc1)C(=O)NOC
    InChI
    InChI=1S/C21H27NO7S/c1-4-27-20(21(23)22-26-2)15-17-7-9-18(10-8-17)28-14-13-16-5-11-19(12-6-16)29-30(3,24)25/h5-12,20H,4,13-15H2,1-3H3,(H,22,23)/t20-/m0/s1
    MOLECULAR FORMULA
    C21H27NO7S
    CROSS REFERENCES
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    canSAR2203749
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight437.15
    AlogP2.27
    HBond donors1
    HBond acceptors8
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2203749.