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  1. ALA4764246

    Name:
    N-(2,4-difluorophenyl)-5-methyl-4-(4-methylpiperaz
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    Mol. Formula:
    C19H19F2N5OS

    M.W.:
    403.46

    Type:
    Unknown

    AlogP:
    3.28

    Polar Surface Area:
    61.36

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  2. ALA4082465

    Name:
    (R)-(-)-7-amino-1-(2,5-dimethoxyphenyl)-3-propylpy
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    Mol. Formula:
    C18H20N4O4

    M.W.:
    356.38

    Type:
    Small molecule

    AlogP:
    1.56

    Polar Surface Area:
    101.37

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  3. ALA5283294

    Name:
    3-(4-chloro-3,5-difluorophenyl)-N-cyclopropylimida
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    Mol. Formula:
    C16H11ClF2N4O

    M.W.:
    348.74

    Type:
    ---

    AlogP:
    3.22

    Polar Surface Area:
    59.29

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  4. ALA4208249

    Name:
    (R)-3-(5-Ethylfuran-2-yl)-2-(5-(pyridin-2-yl)pyrim
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    Mol. Formula:
    C26H21N5O2

    M.W.:
    435.49

    Type:
    Small molecule

    AlogP:
    4.65

    Polar Surface Area:
    87.91

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  5. ALA4205338

    Name:
    (R)-3-(5-Ethylthiophen-2-yl)-2-(5-(pyridin-2-yl)py
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    Mol. Formula:
    C26H21N5OS

    M.W.:
    451.56

    Type:
    Small molecule

    AlogP:
    5.11

    Polar Surface Area:
    74.77

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. ALA4110913

    Name:
    US8865662, 1

    Mol. Formula:
    C66H101Cl2N5O17

    M.W.:
    1307.46

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA3676257

    Name:
    US8829190, 128

    Mol. Formula:
    C17H14Cl2N4O3

    M.W.:
    393.23

    Type:
    Small molecule

    AlogP:
    2.98

    Polar Surface Area:
    83.43

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  8. ALA3676256

    Name:
    US8829190, 127

    Mol. Formula:
    C18H16ClN3O2

    M.W.:
    341.80

    Type:
    Small molecule

    AlogP:
    3.69

    Polar Surface Area:
    56.49

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  9. ALA3676255

    Name:
    US8829190, 126

    Mol. Formula:
    C17H16ClN5O3

    M.W.:
    373.80

    Type:
    Small molecule

    AlogP:
    1.63

    Polar Surface Area:
    102.50

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  10. ALA3676254

    Name:
    US8829190, 125

    Mol. Formula:
    C19H17N5O3

    M.W.:
    363.38

    Type:
    Small molecule

    AlogP:
    1.45

    Polar Surface Area:
    113.40

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  11. ALA3676253

    Name:
    US8829190, 124

    Mol. Formula:
    C18H17BrN4O3

    M.W.:
    417.26

    Type:
    Small molecule

    AlogP:
    2.34

    Polar Surface Area:
    89.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  12. ALA3676252

    Name:
    US8829190, 123

    Mol. Formula:
    C18H16Br2N4O3

    M.W.:
    496.16

    Type:
    Small molecule

    AlogP:
    3.11

    Polar Surface Area:
    89.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  13. ALA3676251

    Name:
    US8829190, 122

    Mol. Formula:
    C18H18N4O3

    M.W.:
    338.37

    Type:
    Small molecule

    AlogP:
    1.58

    Polar Surface Area:
    89.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  14. ALA3676250

    Name:
    US8829190, 121

    Mol. Formula:
    C22H20N4O3

    M.W.:
    388.43

    Type:
    Small molecule

    AlogP:
    2.74

    Polar Surface Area:
    89.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  15. ALA3676249

    Name:
    US8829190, 120

    Mol. Formula:
    C17H17N5O3

    M.W.:
    339.36

    Type:
    Small molecule

    AlogP:
    0.98

    Polar Surface Area:
    102.50

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  16. ALA3676248

    Name:
    US8829190, 119

    Mol. Formula:
    C25H23Cl2N5O2

    M.W.:
    496.40

    Type:
    Small molecule

    AlogP:
    4.69

    Polar Surface Area:
    81.41

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  17. ALA3676247

    Name:
    US8829190, 118

    Mol. Formula:
    C18H15Cl2N5O3

    M.W.:
    420.26

    Type:
    Small molecule

    AlogP:
    2.38

    Polar Surface Area:
    112.47

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  18. ALA3676246

    Name:
    US8829190, 117

    Mol. Formula:
    C21H21Cl2N5O3

    M.W.:
    462.34

    Type:
    Small molecule

    AlogP:
    3.42

    Polar Surface Area:
    98.48

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  19. ALA3676245

    Name:
    US8829190, 116

    Mol. Formula:
    C23H23Cl2N5O3

    M.W.:
    488.38

    Type:
    Small molecule

    AlogP:
    3.96

    Polar Surface Area:
    98.48

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  20. ALA3676244

    Name:
    US8829190, 115

    Mol. Formula:
    C23H25Cl2N5O3

    M.W.:
    490.39

    Type:
    Small molecule

    AlogP:
    4.06

    Polar Surface Area:
    98.48

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
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