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canSAR1830007
FEATURES
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NAMES
    SMILES
    O=C1NC(=S)NC(=O)C1=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1
    InChI
    InChI=1S/C17H18N2O8S/c20-6-10-11(21)12(22)13(23)16(27-10)26-8-3-1-7(2-4-8)5-9-14(24)18-17(28)19-15(9)25/h1-5,10-13,16,20-23H,6H2,(H2,18,19,24,25,28)
    MOLECULAR FORMULA
    C17H18N2O8S
    CROSS REFERENCES
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    canSAR1830007

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.08
    AlogP -2.22
    HBond donors 6
    HBond acceptors 10
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830007.