canSAR1087836
FEATURES
Loading...
NAMES
    SMILES
    CCOC(=O)C(=CNc1ccc2c(c1)C(Nc1ccc(Cl)cc1)=NS2(=O)=O)C(=O)OCC
    InChI
    InChI=1S/C21H20ClN3O6S/c1-3-30-20(26)17(21(27)31-4-2)12-23-15-9-10-18-16(11-15)19(25-32(18,28)29)24-14-7-5-13(22)6-8-14/h5-12,23H,3-4H2,1-2H3,(H,24,25)
    MOLECULAR FORMULA
    C21H20ClN3O6S
    CROSS REFERENCES
    Loading...
    canSAR1087836
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight477.08
    AlogP3.32
    HBond donors2
    HBond acceptors9
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087836.