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  1. ALA3637830

    Name:

    Mol. Formula:
    C19H23N3O2S

    M.W.:
    357.48

    Type:
    Small molecule

    AlogP:
    2.82

    Polar Surface Area:
    45.67

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  2. ALA3637829

    Name:

    Mol. Formula:
    C18H20N2O3

    M.W.:
    312.37

    Type:
    Small molecule

    AlogP:
    2.65

    Polar Surface Area:
    71.19

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  3. ALA3637828

    Name:

    Mol. Formula:
    C20H19FN4O

    M.W.:
    350.40

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    59.93

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  4. ALA3637827

    Name:

    Mol. Formula:
    C19H16F3N3O2

    M.W.:
    375.35

    Type:
    Small molecule

    AlogP:
    3.15

    Polar Surface Area:
    63.99

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  5. ALA3637826

    Name:

    Mol. Formula:
    C14H15NO2

    M.W.:
    229.28

    Type:
    Small molecule

    AlogP:
    2.60

    Polar Surface Area:
    38.33

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.88

    DETAILS
  6. ALA3637825

    Name:

    Mol. Formula:
    C15H8ClF3N4OS

    M.W.:
    384.77

    Type:
    Small molecule

    AlogP:
    3.87

    Polar Surface Area:
    70.19

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  7. ALA3637824

    Name:

    Mol. Formula:
    C25H24N6O2

    M.W.:
    440.51

    Type:
    Small molecule

    AlogP:
    4.41

    Polar Surface Area:
    104.03

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  8. ALA3637823

    Name:

    Mol. Formula:
    C21H22ClN3OS

    M.W.:
    399.95

    Type:
    Small molecule

    AlogP:
    5.00

    Polar Surface Area:
    47.04

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  9. ALA3637822

    Name:

    Mol. Formula:
    C16H22N4O3S2

    M.W.:
    382.51

    Type:
    Small molecule

    AlogP:
    3.10

    Polar Surface Area:
    101.91

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  10. ALA3637821

    Name:

    Mol. Formula:
    C21H21FN4OS

    M.W.:
    396.49

    Type:
    Small molecule

    AlogP:
    4.83

    Polar Surface Area:
    58.12

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  11. ALA3637820

    Name:

    Mol. Formula:
    C11H9NO4

    M.W.:
    219.20

    Type:
    Small molecule

    AlogP:
    1.21

    Polar Surface Area:
    80.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  12. ALA3637819

    Name:

    Mol. Formula:
    C17H23N5O2

    M.W.:
    329.40

    Type:
    Small molecule

    AlogP:
    1.70

    Polar Surface Area:
    81.93

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  13. ALA3637818

    Name:

    Mol. Formula:
    C19H15F4N3O4

    M.W.:
    425.34

    Type:
    Small molecule

    AlogP:
    2.10

    Polar Surface Area:
    115.31

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  14. ALA3637817

    Name:

    Mol. Formula:
    C23H28FN5O4S

    M.W.:
    489.57

    Type:
    Small molecule

    AlogP:
    3.88

    Polar Surface Area:
    111.31

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  15. ALA3637816

    Name:

    Mol. Formula:
    C16H12FN3O3S

    M.W.:
    345.36

    Type:
    Small molecule

    AlogP:
    3.63

    Polar Surface Area:
    74.20

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  16. ALA3637815

    Name:

    Mol. Formula:
    C12H10N4O2S2

    M.W.:
    306.37

    Type:
    Small molecule

    AlogP:
    2.72

    Polar Surface Area:
    80.91

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  17. ALA3637814

    Name:

    Mol. Formula:
    C12H5F3N6O2S

    M.W.:
    354.27

    Type:
    Small molecule

    AlogP:
    2.94

    Polar Surface Area:
    95.14

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  18. ALA3637813

    Name:

    Mol. Formula:
    C22H25N3OS

    M.W.:
    379.53

    Type:
    Small molecule

    AlogP:
    5.20

    Polar Surface Area:
    41.30

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  19. ALA3637812

    Name:

    Mol. Formula:
    C25H26FN7O2

    M.W.:
    475.53

    Type:
    Small molecule

    AlogP:
    3.45

    Polar Surface Area:
    101.08

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  20. ALA3637811

    Name:

    Mol. Formula:
    C12H13N3O

    M.W.:
    215.26

    Type:
    Small molecule

    AlogP:
    2.42

    Polar Surface Area:
    60.17

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
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