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canSAR385132
FEATURES
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NAMES
    SMILES
    COc1ccc(/C=C(\C)C(=O)N[C@@H]2[C@H](O)[C@@H](O)[C@H]3OCO[C@H]3[C@@H]2O)cc1O
    InChI
    InChI=1S/C18H23NO8/c1-8(5-9-3-4-11(25-2)10(20)6-9)18(24)19-12-13(21)15(23)17-16(14(12)22)26-7-27-17/h3-6,12-17,20-23H,7H2,1-2H3,(H,19,24)/b8-5+/t12-,13+,14-,15-,16+,17-/m1/s1
    MOLECULAR FORMULA
    C18H23NO8
    CROSS REFERENCES
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    canSAR385132

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.14
    AlogP -0.87
    HBond donors 5
    HBond acceptors 9
    Atoms 50
    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 canSAR385132.