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  1. ALA4093840

    Name:
    2-(4-Methyl-3-propionamidophenylamino)-N-(2-methyl
    Show More

    Mol. Formula:
    C31H30F3N7O3

    M.W.:
    605.62

    Type:
    Small molecule

    AlogP:
    6.75

    Polar Surface Area:
    137.14

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  2. ALA4090174

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C32H30FN7O3

    M.W.:
    579.64

    Type:
    Small molecule

    AlogP:
    6.24

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  3. ALA4089476

    Name:
    2-(3-Acrylamido-4-methylphenylamino)-N-(5-(3,4-dim
    Show More

    Mol. Formula:
    C32H33N7O5

    M.W.:
    595.66

    Type:
    Small molecule

    AlogP:
    5.53

    Polar Surface Area:
    155.60

    HBA:
    9

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  4. ALA4088068

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C33H31N7O5

    M.W.:
    605.66

    Type:
    Small molecule

    AlogP:
    5.56

    Polar Surface Area:
    138.02

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  5. ALA4087478

    Name:
    2-(4-Methyl-3-propionamidophenylamino)-N-(2-methyl
    Show More

    Mol. Formula:
    C33H37N7O6

    M.W.:
    627.70

    Type:
    Small molecule

    AlogP:
    5.76

    Polar Surface Area:
    164.83

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  6. ALA4087169

    Name:
    N-(3-(7-(3-Acrylamido-4-methylphenylamino)-1-methy
    Show More

    Mol. Formula:
    C32H31N7O4

    M.W.:
    577.65

    Type:
    Small molecule

    AlogP:
    5.80

    Polar Surface Area:
    128.79

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  7. ALA4086774

    Name:
    (trans)-N-(3-(7-(3-Acrylamido-4-methylphenylamino)
    Show More

    Mol. Formula:
    C34H41N7O3

    M.W.:
    595.75

    Type:
    Small molecule

    AlogP:
    6.94

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  8. ALA4744156

    Name:
    4-{[6-Fluoro-4-hydroxy-8-(methylamino)-2-oxo-1,2-d
    Show More

    Mol. Formula:
    C18H14FN3O5

    M.W.:
    371.32

    Type:
    Unknown

    AlogP:
    2.37

    Polar Surface Area:
    131.52

    HBA:
    5

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  9. ALA4083564

    Name:
    2-(3-Acrylamido-4-methylphenylamino)-N-(5-(4-metho
    Show More

    Mol. Formula:
    C31H31N7O4

    M.W.:
    565.63

    Type:
    Small molecule

    AlogP:
    5.52

    Polar Surface Area:
    146.37

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  10. ALA4082327

    Name:
    (S)-2-Amino-N-(3-(7-(3-acrylamido-4-methylphenylam
    Show More

    Mol. Formula:
    C35H35N9O3

    M.W.:
    629.73

    Type:
    Small molecule

    AlogP:
    5.53

    Polar Surface Area:
    161.37

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  11. ALA4080192

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C33H30F3N7O3

    M.W.:
    629.64

    Type:
    Small molecule

    AlogP:
    7.12

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  12. ALA4069109

    Name:
    N-(3-(7-(3-Acrylamido-4-methylphenylamino)-1-methy
    Show More

    Mol. Formula:
    C32H30FN7O3

    M.W.:
    579.64

    Type:
    Small molecule

    AlogP:
    6.24

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  13. ALA4068448

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C33H33N7O5

    M.W.:
    607.67

    Type:
    Small molecule

    AlogP:
    5.81

    Polar Surface Area:
    138.02

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  14. ALA4068296

    Name:
    2-(3-Acrylamido-4-methylphenylamino)-N-(5-(benzo[d
    Show More

    Mol. Formula:
    C31H29N7O5

    M.W.:
    579.62

    Type:
    Small molecule

    AlogP:
    5.24

    Polar Surface Area:
    155.60

    HBA:
    9

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  15. ALA4066104

    Name:
    2-(3-Acrylamido-4-methylphenylamino)-N-(2-methyl-5
    Show More

    Mol. Formula:
    C33H35N7O6

    M.W.:
    625.69

    Type:
    Small molecule

    AlogP:
    5.53

    Polar Surface Area:
    164.83

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  16. ALA4065746

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C33H33N7O5

    M.W.:
    607.67

    Type:
    Small molecule

    AlogP:
    5.81

    Polar Surface Area:
    138.02

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  17. ALA4065343

    Name:
    (trans)-N-(3-(7-((3-Acrylamido-4-methylphenyl)amin
    Show More

    Mol. Formula:
    C34H41N7O3

    M.W.:
    595.75

    Type:
    Small molecule

    AlogP:
    7.08

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  18. ALA4086091

    Name:
    (trans)-N-(3-(7-(3-Acrylamido-4-methylphenylamino)
    Show More

    Mol. Formula:
    C35H43N7O3

    M.W.:
    609.77

    Type:
    Small molecule

    AlogP:
    7.47

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  19. ALA4084978

    Name:
    2-(3-Acrylamido-4-methylphenylamino)-N-(2-methyl-5
    Show More

    Mol. Formula:
    C33H35N7O6

    M.W.:
    625.69

    Type:
    Small molecule

    AlogP:
    5.53

    Polar Surface Area:
    164.83

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  20. ALA4079864

    Name:
    N-(3-(7-((3-Acrylamido-4-methylphenyl)amino)-1-met
    Show More

    Mol. Formula:
    C33H27F6N7O3

    M.W.:
    683.61

    Type:
    Small molecule

    AlogP:
    7.83

    Polar Surface Area:
    119.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
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