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  1. ALA4476273

    Name:
    3-(4-hydroxybenzyl)-6-(4-hydroxyphenethyl)-2,2-dim
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    Mol. Formula:
    C22H27NO3

    M.W.:
    353.46

    Type:
    Unknown

    AlogP:
    3.60

    Polar Surface Area:
    69.56

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  2. ALA4537499

    Name:
    4,6-dimethyl-5-(m-chlorophenyl)-2-[(4-phenyl-1-pip
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    Mol. Formula:
    C25H25ClN4O2

    M.W.:
    448.95

    Type:
    Unknown

    AlogP:
    4.12

    Polar Surface Area:
    48.79

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  3. ALA4537150

    Name:
    4,6-dimethyl-5-phenyl-2-{[4-(o-ethoxyphenyl)-1-pip
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    Mol. Formula:
    C27H30N4O3

    M.W.:
    458.56

    Type:
    Unknown

    AlogP:
    3.87

    Polar Surface Area:
    58.02

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  4. ALA4536976

    Name:
    6-(2-(Pyridin-3-yl)ethenyl)-4,5-dihydropyridazin-3
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    Mol. Formula:
    C11H11N3O

    M.W.:
    201.23

    Type:
    Unknown

    AlogP:
    1.36

    Polar Surface Area:
    54.35

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.79

    DETAILS
  5. ALA4532877

    Name:
    N-[4-cyano-1-(4-sulfamoylphenyl)-1H-pyrazol-5-yl]-
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    Mol. Formula:
    C16H18N6O4S

    M.W.:
    390.43

    Type:
    Unknown

    AlogP:
    -0.34

    Polar Surface Area:
    143.34

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  6. ALA4531165

    Name:
    2-Chloro-N-[4-cyano-1-(4-sulfamoylphenyl)-1H-pyraz
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    Mol. Formula:
    C12H10ClN5O3S

    M.W.:
    339.76

    Type:
    Unknown

    AlogP:
    0.57

    Polar Surface Area:
    130.87

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  7. ALA4569790

    Name:
    4-[4-Cyano-5-(4-fluorobenzylidene)amino-1H-pyrazol
    Show More

    Mol. Formula:
    C17H12FN5O2S

    M.W.:
    369.38

    Type:
    Unknown

    AlogP:
    2.28

    Polar Surface Area:
    114.13

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  8. ALA4567195

    Name:
    4-[5-(4-Bromobenzylidene)amino-4-cyano-1H-pyrazol-
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    Mol. Formula:
    C17H12BrN5O2S

    M.W.:
    430.29

    Type:
    Unknown

    AlogP:
    2.90

    Polar Surface Area:
    114.13

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  9. ALA4529760

    Name:
    6-(2-(2-Methoxyphenyl)ethenyl)-4,5-dihydropyridazi
    Show More

    Mol. Formula:
    C13H14N2O2

    M.W.:
    230.27

    Type:
    Unknown

    AlogP:
    1.97

    Polar Surface Area:
    50.69

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.86

    DETAILS
  10. ALA4528376

    Name:
    4,6-dimethyl-5-phenyl-2-[(4-phenyl-1-piperazinyl)m
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    Mol. Formula:
    C25H26N4O2

    M.W.:
    414.51

    Type:
    Unknown

    AlogP:
    3.47

    Polar Surface Area:
    48.79

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  11. ALA4547736

    Name:
    2-(4-Fluorophenyl)-6-(2-(3-Methylphenyl)ethenyl)-4
    Show More

    Mol. Formula:
    C19H17FN2O

    M.W.:
    308.36

    Type:
    Unknown

    AlogP:
    4.33

    Polar Surface Area:
    32.67

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  12. ALA4546047

    Name:
    4,6-dimethyl-5-n-butyl-2-{[4-(o-ethoxyphenyl)-1-pi
    Show More

    Mol. Formula:
    C25H34N4O3

    M.W.:
    438.57

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    58.02

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  13. ALA4745350

    Name:
    4-((2-(4-(4-(methylsulfonyl)phenyl)thiazol-2-yl)hy
    Show More

    Mol. Formula:
    C17H15N3O4S2

    M.W.:
    389.46

    Type:
    Unknown

    AlogP:
    3.07

    Polar Surface Area:
    111.88

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  14. ALA4743827

    Name:
    N-(2-(1H-indol-3-yl)ethyl)-2,4-dihydroxybenzamide

    Mol. Formula:
    C17H16N2O3

    M.W.:
    296.33

    Type:
    Unknown

    AlogP:
    2.55

    Polar Surface Area:
    85.35

    HBA:
    3

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  15. ALA4740522

    Name:
    N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-2-(phenylamin
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    Mol. Formula:
    C24H23N3O2

    M.W.:
    385.47

    Type:
    Unknown

    AlogP:
    4.89

    Polar Surface Area:
    66.15

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  16. ALA4763059

    Name:
    2-Methoxy-5-((2-(4-(4-(methylsulfonyl)phenyl)thiaz
    Show More

    Mol. Formula:
    C18H17N3O4S2

    M.W.:
    403.49

    Type:
    Unknown

    AlogP:
    3.37

    Polar Surface Area:
    100.88

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  17. ALA4762525

    Name:
    N-(2-(1H-indol-3-yl)ethyl)-2-hydroxy-5-methylbenza
    Show More

    Mol. Formula:
    C18H18N2O2

    M.W.:
    294.35

    Type:
    Unknown

    AlogP:
    3.15

    Polar Surface Area:
    65.12

    HBA:
    2

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  18. ALA4761676

    Name:
    N-(2-(5-chloro-1H-indol-3-yl)ethyl)-2-(phenylamino
    Show More

    Mol. Formula:
    C23H20ClN3O

    M.W.:
    389.89

    Type:
    Unknown

    AlogP:
    5.54

    Polar Surface Area:
    56.92

    HBA:
    2

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  19. ALA4761194

    Name:
    2-(2-(2,5-dimethoxybenzylidene)hydrazineyl)-4-(4-(
    Show More

    Mol. Formula:
    C19H19N3O4S2

    M.W.:
    417.51

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    89.88

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  20. ALA4574755

    Name:
    2-(4-Fluorophenyl)-6-(2-(3-methylphenyl)ethenyl)py
    Show More

    Mol. Formula:
    C19H15FN2O

    M.W.:
    306.34

    Type:
    Unknown

    AlogP:
    3.85

    Polar Surface Area:
    34.89

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
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