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canSAR1720852
FEATURES
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NAMES
    SMILES
    CC(=O)OCC1C[C@@H](O)[C@H](O)C(=O)C1=O
    InChI
    InChI=1S/C9H12O6/c1-4(10)15-3-5-2-6(11)8(13)9(14)7(5)12/h5-6,8,11,13H,2-3H2,1H3/t5?,6-,8+/m1/s1
    MOLECULAR FORMULA
    C9H12O6
    CROSS REFERENCES
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    canSAR1720852

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 216.06
    AlogP -1.57
    HBond donors 2
    HBond acceptors 6
    Atoms 27
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1720852.