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  1. ALA1089159

    Name:
    2-phenyl-1,1-di(pyridin-3-yl)-2-(pyrrolidin-1-yl)e
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    Mol. Formula:
    C22H23N3O

    M.W.:
    345.45

    Type:
    Small molecule

    AlogP:
    3.55

    Polar Surface Area:
    49.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  2. ALA1090160

    Name:
    2-phenyl-2-(piperidin-1-yl)-1,1-di(pyridin-3-yl)et
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    Mol. Formula:
    C23H25N3O

    M.W.:
    359.47

    Type:
    Small molecule

    AlogP:
    3.94

    Polar Surface Area:
    49.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  3. ALA1090159

    Name:
    2-phenyl-2-(piperazin-1-yl)-1,1-di(pyridin-3-yl)et
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    Mol. Formula:
    C22H24N4O

    M.W.:
    360.46

    Type:
    Small molecule

    AlogP:
    2.36

    Polar Surface Area:
    61.28

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  4. ALA1091163

    Name:
    2-(1,4-oxazepan-4-yl)-2-phenyl-1,1-di(pyridin-3-yl
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    Mol. Formula:
    C23H25N3O2

    M.W.:
    375.47

    Type:
    Small molecule

    AlogP:
    3.18

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  5. ALA1091162

    Name:
    2-(diethylamino)-2-phenyl-1,1-di(pyridin-3-yl)etha
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    Mol. Formula:
    C22H25N3O

    M.W.:
    347.46

    Type:
    Small molecule

    AlogP:
    3.80

    Polar Surface Area:
    49.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  6. ALA1090818

    Name:
    2-(azetidin-1-yl)-2-phenyl-1,1-di(pyridin-3-yl)eth
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    Mol. Formula:
    C21H21N3O

    M.W.:
    331.42

    Type:
    Small molecule

    AlogP:
    3.16

    Polar Surface Area:
    49.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  7. ALA1090817

    Name:
    2-(dimethylamino)-2-phenyl-1,1-di(pyridin-3-yl)eth
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    Mol. Formula:
    C20H21N3O

    M.W.:
    319.41

    Type:
    Small molecule

    AlogP:
    3.02

    Polar Surface Area:
    49.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  8. ALA1090816

    Name:
    2-amino-2-phenyl-1,1-di(pyridin-3-yl)ethanol

    Mol. Formula:
    C18H17N3O

    M.W.:
    291.35

    Type:
    Small molecule

    AlogP:
    2.41

    Polar Surface Area:
    72.03

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  9. ALA1088805

    Name:
    2-phenyl-1,1-di(pyridin-3-yl)ethanol

    Mol. Formula:
    C18H16N2O

    M.W.:
    276.34

    Type:
    Small molecule

    AlogP:
    2.96

    Polar Surface Area:
    46.01

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  10. ALA1088804

    Name:
    2-morpholino-1,1-di(pyridin-3-yl)octan-1-ol

    Mol. Formula:
    C22H31N3O2

    M.W.:
    369.51

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  11. ALA1088803

    Name:
    2-morpholino-1,1-di(pyridin-3-yl)hexan-1-ol

    Mol. Formula:
    C20H27N3O2

    M.W.:
    341.46

    Type:
    Small molecule

    AlogP:
    2.60

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  12. ALA1091880

    Name:
    2-morpholino-3-phenyl-1,1-di(pyridin-3-yl)propan-1
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    Mol. Formula:
    C23H25N3O2

    M.W.:
    375.47

    Type:
    Small molecule

    AlogP:
    2.66

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  13. ALA1091879

    Name:
    3-methyl-2-morpholino-1,1-di(pyridin-3-yl)butan-1-
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    Mol. Formula:
    C19H25N3O2

    M.W.:
    327.43

    Type:
    Small molecule

    AlogP:
    2.07

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  14. ALA1090795

    Name:
    2-morpholino-1,1-di(pyridin-3-yl)propan-1-ol

    Mol. Formula:
    C17H21N3O2

    M.W.:
    299.37

    Type:
    Small molecule

    AlogP:
    1.43

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  15. ALA1090794

    Name:
    2-morpholino-2-phenyl-1,1-di(pyridin-3-yl)ethanol

    Mol. Formula:
    C22H23N3O2

    M.W.:
    361.45

    Type:
    Small molecule

    AlogP:
    2.79

    Polar Surface Area:
    58.48

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  16. ALA1090793

    Name:
    3-methyl-2-morpholino-1,1-diphenylbutan-1-ol

    Mol. Formula:
    C21H27NO2

    M.W.:
    325.45

    Type:
    Small molecule

    AlogP:
    3.28

    Polar Surface Area:
    32.70

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.92

    DETAILS
  17. ALA1090792

    Name:
    2-methyl-1-morpholino-1-phenylpropan-2-ol

    Mol. Formula:
    C14H21NO2

    M.W.:
    235.33

    Type:
    Small molecule

    AlogP:
    1.83

    Polar Surface Area:
    32.70

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.87

    DETAILS
  18. ALA1090791

    Name:
    2-morpholino-2-phenylethanol

    Cas Number:
    20245-73-2

    Mol. Formula:
    C12H17NO2

    M.W.:
    207.27

    Type:
    Small molecule

    AlogP:
    1.05

    Polar Surface Area:
    32.70

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.80

    DETAILS
  19. ALA1091863

    Name:
    2-morpholino-1,1,2-triphenylethanol

    Mol. Formula:
    C24H25NO2

    M.W.:
    359.47

    Type:
    Small molecule

    AlogP:
    4.00

    Polar Surface Area:
    32.70

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  20. Type:
    Small molecule

    AlogP:
    5.46

    Polar Surface Area:
    17.07

    HBA:
    1

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
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