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  1. ALA4531944

    Name:
    7-(4-(5-chloro-2-(2,4-dichlorophenoxy)phenoxy)buto
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    Mol. Formula:
    C25H19Cl3O5

    M.W.:
    505.78

    Type:
    Unknown

    AlogP:
    7.78

    Polar Surface Area:
    57.90

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  2. ALA4560195

    Name:
    7-(4-(5-chloro-2-(2,4-dichlorophenoxy)phenoxy)buto
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    Mol. Formula:
    C26H21Cl3O5

    M.W.:
    519.81

    Type:
    Unknown

    AlogP:
    8.09

    Polar Surface Area:
    57.90

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  3. ALA4568780

    Name:
    2-(2-phenylthiochroman-4-ylidene)hydrazinecarboxam
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    Mol. Formula:
    C16H15N3OS

    M.W.:
    297.38

    Type:
    Unknown

    AlogP:
    3.30

    Polar Surface Area:
    67.48

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  4. ALA4581673

    Name:
    N'-(2-phenylthiochroman-4-ylidene)isonicotinohydra
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    Mol. Formula:
    C21H17N3OS

    M.W.:
    359.45

    Type:
    Unknown

    AlogP:
    4.45

    Polar Surface Area:
    54.35

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  5. ALA5278236

    Name:
    7-((5-(5-chloro-2-(2,4-dichlorophenoxy)phenoxy)pen
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    Mol. Formula:
    C27H23Cl3O5

    M.W.:
    533.84

    Type:
    ---

    AlogP:
    8.48

    Polar Surface Area:
    57.90

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  6. ALA5286322

    Name:
    7-(3-(5-chloro-2-(2,4-dichlorophenoxy)phenoxy)prop
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    Mol. Formula:
    C25H19Cl3O5

    M.W.:
    505.78

    Type:
    ---

    AlogP:
    7.70

    Polar Surface Area:
    57.90

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  7. ALA5208034

    Name:
    7-((9-(quinolin-8-yloxy)nonyl)oxy)-4H-chromen-4-on
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    Mol. Formula:
    C27H29NO4

    M.W.:
    431.53

    Type:
    ---

    AlogP:
    6.53

    Polar Surface Area:
    61.56

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  8. ALA5205237

    Name:
    3-(3-(4-(3-(furan-2-yl)acryloyl)phenoxy)propyl)-1-
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    Mol. Formula:
    C20H21BrN2O3

    M.W.:
    417.30

    Type:
    ---

    AlogP:
    3.27

    Polar Surface Area:
    48.25

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  9. ALA5199525

    Name:
    2-(4-fluorophenyl)-4H-thiochromen-4-one 1,1-dioxid
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    Mol. Formula:
    C15H9FO3S

    M.W.:
    288.30

    Type:
    ---

    AlogP:
    2.84

    Polar Surface Area:
    51.21

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.81

    DETAILS
  10. ALA5193371

    Name:
    3-(8-(4-(3-(furan-2-yl)acryloyl)phenoxy)octyl)-1-m
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    Mol. Formula:
    C25H31BrN2O3

    M.W.:
    487.44

    Type:
    ---

    AlogP:
    5.22

    Polar Surface Area:
    48.25

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  11. ALA5192109

    Name:
    3-(8-(4-(3-(furan-2-yl)acryloyl)phenoxy)dodecyl)-1
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    Mol. Formula:
    C29H39BrN2O3

    M.W.:
    543.55

    Type:
    ---

    AlogP:
    6.78

    Polar Surface Area:
    48.25

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  12. ALA5191821

    Name:
    3-(8-(4-(3-(furan-2-yl)acryloyl)phenoxy)nonyl)-1-m
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    Mol. Formula:
    C26H33BrN2O3

    M.W.:
    501.47

    Type:
    ---

    AlogP:
    5.61

    Polar Surface Area:
    48.25

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  13. ALA5190983

    Name:
    3-(furan-2-yl)-1-(4-((5-(quinolin-8-yloxy)pentyl)o
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    Mol. Formula:
    C27H25NO4

    M.W.:
    427.50

    Type:
    ---

    AlogP:
    6.35

    Polar Surface Area:
    61.56

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  14. ALA5178111

    Name:
    7-(4-(naphthalen-1-yloxy)butoxy)-4H-chromen-4-one

    Mol. Formula:
    C23H20O4

    M.W.:
    360.41

    Type:
    ---

    AlogP:
    5.18

    Polar Surface Area:
    48.67

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  15. ALA5177826

    Name:
    6-fluoro-2-(4-(trifluoromethyl)phenyl)-4H-thiochro
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    Mol. Formula:
    C16H8F4O3S

    M.W.:
    356.30

    Type:
    ---

    AlogP:
    3.86

    Polar Surface Area:
    51.21

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  16. ALA5175303

    Name:
    N'-(chroman-4-ylidene)benzohydrazide

    Mol. Formula:
    C16H14N2O2

    M.W.:
    266.30

    Type:
    ---

    AlogP:
    2.60

    Polar Surface Area:
    50.69

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.85

    DETAILS
  17. ALA4243950

    Name:
    (E)-3-(3,4-dimethoxyphenyl)-1-(4-(4-(quinolin-8-yl
    Show More

    Mol. Formula:
    C30H29NO5

    M.W.:
    483.56

    Type:
    Small molecule

    AlogP:
    6.39

    Polar Surface Area:
    66.88

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  18. ALA4176418

    Name:
    (E)-1-(4-(3-(5-chloro-2-(2,4-dichlorophenoxy)pheno
    Show More

    Mol. Formula:
    C32H27Cl3O6

    M.W.:
    613.92

    Type:
    Small molecule

    AlogP:
    9.20

    Polar Surface Area:
    63.22

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  19. ALA4168168

    Name:
    4-(5-Chloro-2-(2,4-dichlorophenoxy)phenoxy)butyl(E
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    Mol. Formula:
    C34H31Cl3O6

    M.W.:
    641.97

    Type:
    Small molecule

    AlogP:
    9.98

    Polar Surface Area:
    63.22

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  20. ALA4165806

    Name:
    3-(5-Chloro-2-(2,4-dichlorophenoxy)phenoxy)propyl(
    Show More

    Mol. Formula:
    C33H29Cl3O6

    M.W.:
    627.95

    Type:
    Small molecule

    AlogP:
    9.59

    Polar Surface Area:
    63.22

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
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