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  1. ALA3392623

    Name:
    SID124893880

    Mol. Formula:
    C17H15F2N5O3S

    M.W.:
    407.40

    Type:
    Small molecule

    AlogP:
    2.36

    Polar Surface Area:
    119.11

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  2. ALA3392622

    Name:
    SID124894509

    Mol. Formula:
    C20H15ClFN3O5S

    M.W.:
    463.87

    Type:
    Small molecule

    AlogP:
    3.28

    Polar Surface Area:
    115.32

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  3. ALA3392620

    Name:
    SID124894501

    Mol. Formula:
    C18H14ClFN4O5S2

    M.W.:
    484.92

    Type:
    Small molecule

    AlogP:
    2.14

    Polar Surface Area:
    149.18

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  4. ALA3392606

    Name:
    SID26755394

    Mol. Formula:
    C17H15NO3S

    M.W.:
    313.38

    Type:
    Small molecule

    AlogP:
    3.65

    Polar Surface Area:
    55.40

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  5. ALA3392581

    Name:
    SID50113244

    Mol. Formula:
    C15H14ClN7O3S

    M.W.:
    407.84

    Type:
    Small molecule

    AlogP:
    2.04

    Polar Surface Area:
    122.80

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  6. ALA3392547

    Name:
    SID124893566

    Mol. Formula:
    C14H15NO4S

    M.W.:
    293.34

    Type:
    Small molecule

    AlogP:
    2.50

    Polar Surface Area:
    64.63

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.92

    DETAILS
  7. ALA3392537

    Name:
    SID124893940

    Mol. Formula:
    C22H20N2O5S

    M.W.:
    424.48

    Type:
    Small molecule

    AlogP:
    3.36

    Polar Surface Area:
    101.57

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  8. ALA3392342

    Name:
    SID99431128

    Mol. Formula:
    C20H18F2N6O3S2

    M.W.:
    492.53

    Type:
    Small molecule

    AlogP:
    3.20

    Polar Surface Area:
    129.73

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  9. ALA3392341

    Name:
    SID99431165

    Mol. Formula:
    C17H14N2O3S

    M.W.:
    326.38

    Type:
    Small molecule

    AlogP:
    2.99

    Polar Surface Area:
    80.15

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  10. ALA3392336

    Name:
    SID124898104

    Mol. Formula:
    C17H19NO6S

    M.W.:
    365.41

    Type:
    Small molecule

    AlogP:
    2.25

    Polar Surface Area:
    111.98

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  11. ALA3392333

    Name:
    SID124898358

    Mol. Formula:
    C20H19NO7S

    M.W.:
    417.44

    Type:
    Small molecule

    AlogP:
    2.51

    Polar Surface Area:
    121.21

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  12. ALA3391768

    Name:
    SID85302086

    Mol. Formula:
    C19H32O4

    M.W.:
    324.46

    Type:
    Small molecule

    AlogP:
    1.69

    Polar Surface Area:
    80.92

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  13. ALA3391766

    Name:
    SID85302085

    Mol. Formula:
    C24H40N2O4

    M.W.:
    420.59

    Type:
    Small molecule

    AlogP:
    2.77

    Polar Surface Area:
    101.65

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  14. ALA3391762

    Name:
    SID89853734

    Mol. Formula:
    C20H30O3

    M.W.:
    318.46

    Type:
    Small molecule

    AlogP:
    3.53

    Polar Surface Area:
    54.37

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  15. ALA3391761

    Name:
    SID85305142

    Mol. Formula:
    C19H32O3

    M.W.:
    308.46

    Type:
    Small molecule

    AlogP:
    2.72

    Polar Surface Area:
    60.69

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  16. ALA3391760

    Name:
    SID85149182

    Mol. Formula:
    C36H62O10

    M.W.:
    654.88

    Type:
    Small molecule

    AlogP:
    2.27

    Polar Surface Area:
    180.30

    HBA:
    10

    HBD:
    8

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  17. ALA3391754

    Name:
    SID85302054

    Mol. Formula:
    C23H34O6

    M.W.:
    406.52

    Type:
    Small molecule

    AlogP:
    3.04

    Polar Surface Area:
    89.90

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  18. ALA3391753

    Name:
    SID24808234

    Mol. Formula:
    C18H19N3OS

    M.W.:
    325.44

    Type:
    Small molecule

    AlogP:
    3.90

    Polar Surface Area:
    63.97

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  19. ALA3391751

    Name:
    SID85305114

    Mol. Formula:
    C19H33NO

    M.W.:
    291.48

    Type:
    Small molecule

    AlogP:
    3.72

    Polar Surface Area:
    46.25

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  20. ALA3391750

    Name:
    SID85305096

    Mol. Formula:
    C19H30O3

    M.W.:
    306.45

    Type:
    Small molecule

    AlogP:
    2.93

    Polar Surface Area:
    57.53

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
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