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  1. Type:
    Small molecule

    AlogP:
    3.76

    Polar Surface Area:
    83.02

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  2. ALA4283413

    Name:
    4-(1,5-bis(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-
    Show More

    Mol. Formula:
    C21H16Cl2N2O2

    M.W.:
    399.28

    Type:
    Small molecule

    AlogP:
    5.76

    Polar Surface Area:
    56.06

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  3. ALA4115540

    Name:
    US9409931, 6

    Mol. Formula:
    C28H40O5

    M.W.:
    456.62

    Type:
    Small molecule

    AlogP:
    4.37

    Polar Surface Area:
    83.83

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  4. ALA4113544

    Name:
    US9409931, 7

    Mol. Formula:
    C28H40O5

    M.W.:
    456.62

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    83.83

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  5. ALA4111556

    Name:
    US9409931, 5

    Mol. Formula:
    C28H40O4

    M.W.:
    440.62

    Type:
    Small molecule

    AlogP:
    5.25

    Polar Surface Area:
    63.60

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  6. ALA3926213

    Name:
    US9409931, 8

    Mol. Formula:
    C27H38O6

    M.W.:
    458.60

    Type:
    Small molecule

    AlogP:
    3.09

    Polar Surface Area:
    104.06

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  7. ALA3102881

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C28H34ClNO6

    M.W.:
    516.03

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    116.09

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  8. ALA3105111

    Name:
    Ingenol 3-(2-methyl-6-methylamino)-benzoate

    Mol. Formula:
    C29H37NO6

    M.W.:
    495.62

    Type:
    Small molecule

    AlogP:
    3.03

    Polar Surface Area:
    116.09

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  9. ALA3105109

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C27H32FNO6

    M.W.:
    485.55

    Type:
    Small molecule

    AlogP:
    2.40

    Polar Surface Area:
    130.08

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  10. ALA3105108

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C27H32ClNO6

    M.W.:
    502.01

    Type:
    Small molecule

    AlogP:
    2.92

    Polar Surface Area:
    130.08

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  11. ALA3105107

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C28H35NO7

    M.W.:
    497.59

    Type:
    Small molecule

    AlogP:
    2.27

    Polar Surface Area:
    139.31

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  12. ALA3105105

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C28H33ClO6

    M.W.:
    501.02

    Type:
    Small molecule

    AlogP:
    3.64

    Polar Surface Area:
    104.06

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  13. ALA3105101

    Name:
    Ingenol 3-o-hexadecanylamino-benzoate

    Mol. Formula:
    C43H65NO6

    M.W.:
    691.99

    Type:
    Small molecule

    AlogP:
    8.57

    Polar Surface Area:
    116.09

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    19

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  14. ALA3105099

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C34H39NO6

    M.W.:
    557.69

    Type:
    Small molecule

    AlogP:
    4.29

    Polar Surface Area:
    116.09

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  15. ALA3105097

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C27H33NO6

    M.W.:
    467.56

    Type:
    Small molecule

    AlogP:
    2.26

    Polar Surface Area:
    130.08

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  16. ALA3105093

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C30H38O7

    M.W.:
    510.63

    Type:
    Small molecule

    AlogP:
    3.47

    Polar Surface Area:
    113.29

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  17. ALA3105091

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C30H38O6

    M.W.:
    494.63

    Type:
    Small molecule

    AlogP:
    3.80

    Polar Surface Area:
    104.06

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  18. ALA3105090

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C28H34O6

    M.W.:
    466.57

    Type:
    Small molecule

    AlogP:
    2.99

    Polar Surface Area:
    104.06

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  19. ALA3105025

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C35H41NO7

    M.W.:
    587.71

    Type:
    Small molecule

    AlogP:
    4.30

    Polar Surface Area:
    125.32

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  20. ALA3105024

    Name:
    (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydr
    Show More

    Mol. Formula:
    C35H41NO6

    M.W.:
    571.71

    Type:
    Small molecule

    AlogP:
    4.60

    Polar Surface Area:
    116.09

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
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