canSAR1808899
FEATURES
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NAMES
    SMILES
    OC[C@@H]1[C@H](O)[C@H](O)[C@@H](O)CN1C(=S)Nc1cccc2ccccc12
    InChI
    InChI=1S/C17H20N2O4S/c20-9-13-15(22)16(23)14(21)8-19(13)17(24)18-12-7-3-5-10-4-1-2-6-11(10)12/h1-7,13-16,20-23H,8-9H2,(H,18,24)/t13-,14+,15+,16-/m1/s1
    MOLECULAR FORMULA
    C17H20N2O4S
    CROSS REFERENCES
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    canSAR1808899
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight348.11
    AlogP0.30
    HBond donors5
    HBond acceptors6
    Atoms44
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1808899.