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canSAR829145
FEATURES
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NAMES
    SMILES
    C[C@@H]1O[C@@H](O[C@H]2C[C@](O)(C(=O)CO)Cc3c(O)c4c(c(O)c32)C(=O)c2ccccc2C4=O)[C@H](F)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C26H25FO11/c1-9-19(30)24(35)18(27)25(37-9)38-13-7-26(36,14(29)8-28)6-12-15(13)23(34)17-16(22(12)33)20(31)10-4-2-3-5-11(10)21(17)32/h2-5,9,13,18-19,24-25,28,30,33-36H,6-8H2,1H3/t9-,13-,18+,19+,24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C26H25FO11
    CROSS REFERENCES
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    canSAR829145

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.14
    AlogP -0.03
    HBond donors 6
    HBond acceptors 11
    Atoms 63
    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 canSAR829145.