canSAR417829
FEATURES
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NAMES
    SMILES
    CC(C)NCC(O)COc1ccc(N(C)S(C)(=O)=O)cc1
    InChI
    InChI=1S/C14H24N2O4S/c1-11(2)15-9-13(17)10-20-14-7-5-12(6-8-14)16(3)21(4,18)19/h5-8,11,13,15,17H,9-10H2,1-4H3
    MOLECULAR FORMULA
    C14H24N2O4S
    CROSS REFERENCES
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    canSAR417829
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight316.15
    AlogP0.82
    HBond donors2
    HBond acceptors6
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR417829.