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canSAR1830723
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NAMES
    SMILES
    CC1(C)S[C@@H]2[C@@H](CO)C(=O)N2[C@H]1C(=O)[O-]
    InChI
    InChI=1S/C9H13NO4S/c1-9(2)5(8(13)14)10-6(12)4(3-11)7(10)15-9/h4-5,7,11H,3H2,1-2H3,(H,13,14)/p-1/t4-,5-,7+/m0/s1
    MOLECULAR FORMULA
    C9H12NO4S-
    CROSS REFERENCES
    1830723 logo

    canSAR1830723

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 230.05
    AlogP -1.59
    HBond donors 1
    HBond acceptors 5
    Atoms 27
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830723.