canSAR86946
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](C(=O)NC1C(O)OC(CO)C(O)C1O)C(C)(C)SN=O
    InChI
    InChI=1S/C13H23N3O8S/c1-5(18)14-10(13(2,3)25-16-23)11(21)15-7-9(20)8(19)6(4-17)24-12(7)22/h6-10,12,17,19-20,22H,4H2,1-3H3,(H,14,18)(H,15,21)/t6?,7?,8?,9?,10-,12?/m0/s1
    MOLECULAR FORMULA
    C13H23N3O8S
    CROSS REFERENCES
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    canSAR86946
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight381.12
    AlogP-2.40
    HBond donors6
    HBond acceptors11
    Atoms48
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR86946.