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  1. ALA5086647

    Name:
    N-(3-chloro-4-(((cyclohexylmethyl)(propyl)amino)methyl)phenyl)-2-(4-(methylShow More

    Mol. Formula:
    C26H35ClN2O3S

    M.W.:
    491.10

    Type:
    Unknown

    AlogP:
    5.72

    Polar Surface Area:
    66.48

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  2. ALA4540580

    Name:
    4-[3-(2,6-dichlorobenzoyl)indazol-1-yl]benzoic acid

    Mol. Formula:
    C21H12Cl2N2O3

    M.W.:
    411.24

    Type:
    Unknown

    AlogP:
    5.26

    Polar Surface Area:
    72.19

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  3. ALA4454027

    Name:
    4-[3-(2,6-dichlorobenzoyl)indol-1-yl]benzoic acid

    Mol. Formula:
    C22H13Cl2NO3

    M.W.:
    410.26

    Type:
    Unknown

    AlogP:
    5.87

    Polar Surface Area:
    59.30

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  4. ALA4293415

    Name:
    2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)phenyl)-N,2-dimethyl-N-phenylproShow More

    Mol. Formula:
    C27H30N2O4S

    M.W.:
    478.61

    Type:
    Small molecule

    AlogP:
    4.60

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  5. ALA4292660

    Name:
    2-(4-(ethylsulfonyl)phenyl)-N-(4-(2-methyl-1-oxo-1-(2-azaspiro[3.3]heptan-2Show More

    Mol. Formula:
    C26H32N2O4S

    M.W.:
    468.62

    Type:
    Small molecule

    AlogP:
    3.95

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  6. ALA4290041

    Name:
    2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)-2-fluorophenyl)-N-(4-fluorophenShow More

    Mol. Formula:
    C26H26F2N2O4S

    M.W.:
    500.57

    Type:
    Small molecule

    AlogP:
    4.86

    Polar Surface Area:
    92.34

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  7. S18-000003

    Name:
    N-(2,4-difluorophenyl)-2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)-2-fluoroShow More

    Mol. Formula:
    C26H25F3N2O4S

    M.W.:
    518.56

    Type:
    Small molecule

    AlogP:
    5.00

    Polar Surface Area:
    92.34

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  8. ALA4287342

    Name:
    2-(4-(ethylsulfonyl)phenyl)-N-(4-(2-methyl-1-oxo-1-(piperidin-1-yl)propan-2Show More

    Mol. Formula:
    C25H32N2O4S

    M.W.:
    456.61

    Type:
    Small molecule

    AlogP:
    3.95

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  9. ALA4286190

    Name:
    2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)phenyl)-N-(2-fluorophenyl)-2-metShow More

    Mol. Formula:
    C26H27FN2O4S

    M.W.:
    482.58

    Type:
    Small molecule

    AlogP:
    4.72

    Polar Surface Area:
    92.34

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  10. ALA4282801

    Name:
    2-(4-(ethylsulfonyl)phenyl)-N-(4-(1-(indolin-1-yl)-2-methyl-1-oxopropan-2-yShow More

    Mol. Formula:
    C28H30N2O4S

    M.W.:
    490.63

    Type:
    Small molecule

    AlogP:
    4.53

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  11. ALA4282063

    Name:
    N-(4-(1-(azetidin-1-yl)-2-methyl-1-oxopropan-2-yl)phenyl)-2-(4-(ethylsulfonShow More

    Mol. Formula:
    C23H28N2O4S

    M.W.:
    428.55

    Type:
    Small molecule

    AlogP:
    3.17

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  12. ALA4281750

    Name:
    2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)phenyl)-N-(3-fluorophenyl)-2-metShow More

    Mol. Formula:
    C26H27FN2O4S

    M.W.:
    482.58

    Type:
    Small molecule

    AlogP:
    4.72

    Polar Surface Area:
    92.34

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  13. ALA4279772

    Name:
    N-(4-cyanopyridin-2-yl)-2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)-2-fluorShow More

    Mol. Formula:
    C26H25FN4O4S

    M.W.:
    508.58

    Type:
    Small molecule

    AlogP:
    3.98

    Polar Surface Area:
    129.02

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  14. ALA4279420

    Name:
    2-(4-(2-(4-(ethylsulfonyl)phenyl)acetamido)phenyl)-2-methyl-N-phenylpropanaShow More

    Mol. Formula:
    C26H28N2O4S

    M.W.:
    464.59

    Type:
    Small molecule

    AlogP:
    4.58

    Polar Surface Area:
    92.34

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  15. ALA4278285

    Name:
    2-(4-(ethylsulfonyl)phenyl)-N-(4-(1-(isoindolin-2-yl)-2-methyl-1-oxopropan-Show More

    Mol. Formula:
    C28H30N2O4S

    M.W.:
    490.63

    Type:
    Small molecule

    AlogP:
    4.48

    Polar Surface Area:
    83.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  16. ALA4215628

    Name:
    5-(2,6-dicyclopropylpyridin-4-yl)-N-(2-hydroxy-1-(4-(methylsulfonyl)phenyl)Show More

    Mol. Formula:
    C29H32N4O4S

    M.W.:
    532.67

    Type:
    Small molecule

    AlogP:
    4.18

    Polar Surface Area:
    112.49

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  17. ALA4215100

    Name:
    1-(2,6-dicyclopropylpyridin-4-yl)-N-(2-fluoro-4-(methylsulfonyl)benzyl)-2,3Show More

    Mol. Formula:
    C27H27FN4O4S

    M.W.:
    522.60

    Type:
    Small molecule

    AlogP:
    4.23

    Polar Surface Area:
    101.49

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  18. ALA4209300

    Name:
    ethyl 2-((5-(2,6-dicyclopropylpyridin-4-yl)-5,6,7,8-tetrahydro-1,5-naphthyrShow More

    Mol. Formula:
    C32H36N4O5S

    M.W.:
    588.73

    Type:
    Small molecule

    AlogP:
    5.22

    Polar Surface Area:
    118.56

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  19. ALA4208374

    Name:
    1-(2,6-dicyclopropylpyridin-4-yl)-N-(4-(methylsulfonyl)benzyl)-2,3-dihydro-Show More

    Mol. Formula:
    C27H28N4O4S

    M.W.:
    504.61

    Type:
    Small molecule

    AlogP:
    4.10

    Polar Surface Area:
    101.49

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  20. ALA4207784

    Name:
    4-(2,6-dicyclopropylpyridin-4-yl)-N-((5-(methylsulfonyl)pyridin-2-yl)methylShow More

    Mol. Formula:
    C28H29N3O4S

    M.W.:
    503.62

    Type:
    Small molecule

    AlogP:
    4.48

    Polar Surface Area:
    98.25

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
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