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  1. ALA1222312

    Name:
    (3R,4R,5R,6R)-4,5,6-trihydroxytetrahydro-2H-pyran-3-yl benzoate

    Mol. Formula:
    C12H14O6

    M.W.:
    254.24

    Type:
    Small molecule

    AlogP:
    -0.72

    Polar Surface Area:
    96.22

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  2. ALA1222311

    Name:
    ((2R,3S,4S,5S,6R)-3,4,5,6-tetrahydroxytetrahydro-2H-pyran-2-yl)methyl benzoShow More

    Mol. Formula:
    C13H16O7

    M.W.:
    284.26

    Type:
    Small molecule

    AlogP:
    -1.36

    Polar Surface Area:
    116.45

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  3. ALA1222254

    Name:
    octyl beta-D-xyloside

    Mol. Formula:
    C13H26O5

    M.W.:
    262.35

    Type:
    Small molecule

    AlogP:
    0.80

    Polar Surface Area:
    79.15

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  4. ALA1222253

    Name:
    benzyl beta-D-xyloside

    Mol. Formula:
    C12H16O5

    M.W.:
    240.25

    Type:
    Small molecule

    AlogP:
    -0.36

    Polar Surface Area:
    79.15

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  5. ALA1222252

    Name:
    benzyl beta-D-cellobioside

    Mol. Formula:
    C19H28O11

    M.W.:
    432.42

    Type:
    Small molecule

    AlogP:
    -3.17

    Polar Surface Area:
    178.53

    HBA:
    11

    HBD:
    7

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  6. ALA1222152

    Name:
    D-Allose

    Mol. Formula:
    C6H12O6

    M.W.:
    180.16

    Type:
    Small molecule

    AlogP:
    -3.22

    Polar Surface Area:
    110.38

    HBA:
    6

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  7. ALA1222151

    Name:
    octyl beta-D-galactoside

    Mol. Formula:
    C14H28O6

    M.W.:
    292.37

    Type:
    Small molecule

    AlogP:
    0.16

    Polar Surface Area:
    99.38

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
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