canSAR2175056
FEATURES
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NAMES
    SMILES
    CN(C)[C@@H](CCC(=O)Nc1cc(Cl)cc(S(=O)(=O)O)c1O)C(=O)O
    InChI
    InChI=1S/C13H17ClN2O7S/c1-16(2)9(13(19)20)3-4-11(17)15-8-5-7(14)6-10(12(8)18)24(21,22)23/h5-6,9,18H,3-4H2,1-2H3,(H,15,17)(H,19,20)(H,21,22,23)/t9-/m0/s1
    MOLECULAR FORMULA
    C13H17ClN2O7S
    CROSS REFERENCES
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    canSAR2175056
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight380.04
    AlogP1.03
    HBond donors4
    HBond acceptors9
    Atoms41
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2175056.