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canSAR399545
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NAMES
    SMILES
    CC(CS)C(=O)N1CC2(C[C@H]1C(=O)O)SCCCS2
    InChI
    InChI=1S/C12H19NO3S3/c1-8(6-17)10(14)13-7-12(5-9(13)11(15)16)18-3-2-4-19-12/h8-9,17H,2-7H2,1H3,(H,15,16)/t8?,9-/m0/s1
    MOLECULAR FORMULA
    C12H19NO3S3
    CROSS REFERENCES
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    canSAR399545

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 321.05
    AlogP 1.80
    HBond donors 1
    HBond acceptors 4
    Atoms 38
    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 canSAR399545.