canSAR1746094
FEATURES
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NAMES
    SMILES
    O=C(O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2
    InChI
    InChI=1S/C13H17NO4S/c15-13(16)7-8-14-19(17,18)12-6-5-10-3-1-2-4-11(10)9-12/h5-6,9,14H,1-4,7-8H2,(H,15,16)
    MOLECULAR FORMULA
    C13H17NO4S
    CROSS REFERENCES
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    canSAR1746094
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight283.09
    AlogP1.32
    HBond donors2
    HBond acceptors5
    Atoms36
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746094.