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canSAR1976666
FEATURES
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NAMES
    SMILES
    CCN(C[C@H]1N[C@@](C)(C(=O)OC)[C@H]2C(=O)N(C)C(=O)[C@@H]12)S(=O)(=O)c1ccccc1
    InChI
    InChI=1S/C19H25N3O6S/c1-5-22(29(26,27)12-9-7-6-8-10-12)11-13-14-15(17(24)21(3)16(14)23)19(2,20-13)18(25)28-4/h6-10,13-15,20H,5,11H2,1-4H3/t13-,14+,15-,19-/m1/s1
    MOLECULAR FORMULA
    C19H25N3O6S
    CROSS REFERENCES
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    canSAR1976666

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.15
    AlogP -0.17
    HBond donors 1
    HBond acceptors 9
    Atoms 54
    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 canSAR1976666.