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canSAR398286
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NAMES
    SMILES
    CC[C@@H]1CCC[C@H](C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)N1
    InChI
    InChI=1S/C17H31ClN2O5S/c1-4-9-6-5-7-10(19-9)16(24)20-11(8(2)18)15-13(22)12(21)14(23)17(25-15)26-3/h8-15,17,19,21-23H,4-7H2,1-3H3,(H,20,24)/t8?,9-,10-,11?,12?,13?,14?,15?,17?/m1/s1
    MOLECULAR FORMULA
    C17H31ClN2O5S
    CROSS REFERENCES
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    canSAR398286

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.16
    AlogP 0.19
    HBond donors 5
    HBond acceptors 7
    Atoms 57
    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 canSAR398286.