canSAR1632432
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
    InChI
    InChI=1S/C19H21N3O6S/c1-27-16-6-2-14(3-7-16)18(23)20-21-19(24)15-4-8-17(9-5-15)29(25,26)22-10-12-28-13-11-22/h2-9H,10-13H2,1H3,(H,20,23)(H,21,24)
    MOLECULAR FORMULA
    C19H21N3O6S
    CROSS REFERENCES
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    canSAR1632432
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.12
    AlogP0.79
    HBond donors2
    HBond acceptors9
    Atoms50
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632432.