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  1. ALA5280943

    Name:
    4-(3-(4-fluorophenyl)-6-oxopyridazin-1(6H)-yl)-N-(isopropylcarbamoyl)benzenShow More

    Mol. Formula:
    C20H19FN4O4S

    M.W.:
    430.46

    Type:
    ---

    AlogP:
    2.43

    Polar Surface Area:
    110.16

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  2. ALA5279574

    Name:
    2-(3-(benzo[d]thiazol-2-yl)-1H-pyrrol-1-yl)acetic acid

    Mol. Formula:
    C13H10N2O2S

    M.W.:
    258.30

    Type:
    ---

    AlogP:
    2.85

    Polar Surface Area:
    55.12

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  3. ALA5286592

    Name:
    2-(4-(benzo[d]thiazol-2-yl)-2-benzoyl-1H-pyrrol-1-yl)acetic acid

    Mol. Formula:
    C20H14N2O3S

    M.W.:
    362.41

    Type:
    ---

    AlogP:
    4.08

    Polar Surface Area:
    72.19

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  4. ALA5289027

    Name:
    5-((2,8-dimethoxy-5H-dibenzo[a,d][7]annulen-5-yl)methylene)thiazolidine-2,4Show More

    Mol. Formula:
    C21H17NO4S

    M.W.:
    379.44

    Type:
    ---

    AlogP:
    4.19

    Polar Surface Area:
    64.63

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  5. ALA5287998

    Name:
    2,8-dihydroxyspiro[dibenzo[a,d][7]annulene-5,3'-pyrrolidine]-2',5'-dione

    Mol. Formula:
    C18H13NO4

    M.W.:
    307.31

    Type:
    ---

    AlogP:
    1.91

    Polar Surface Area:
    86.63

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  6. ALA4798469

    Name:
    2-(7-(naphthalen-2-yl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C25H17NO4

    M.W.:
    395.41

    Type:
    Unknown

    AlogP:
    5.17

    Polar Surface Area:
    72.44

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  7. ALA4795983

    Name:
    2-(7-([1,1'-biphenyl]-4-yl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C21H15NO4

    M.W.:
    345.35

    Type:
    Unknown

    AlogP:
    4.01

    Polar Surface Area:
    72.44

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  8. ALA4795113

    Name:
    (E)-2-(2-oxo-7-styrylbenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C17H13NO4

    M.W.:
    295.29

    Type:
    Unknown

    AlogP:
    2.85

    Polar Surface Area:
    72.44

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  9. ALA4793830

    Name:
    4-((1H-indol-1-yl)sulfonyl)phenol

    Mol. Formula:
    C14H11NO3S

    M.W.:
    273.31

    Type:
    Unknown

    AlogP:
    2.58

    Polar Surface Area:
    59.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  10. ALA4793347

    Name:
    4-((1H-indol-2-yl)sulfonyl)phenol

    Mol. Formula:
    C14H11NO3S

    M.W.:
    273.31

    Type:
    Unknown

    AlogP:
    2.71

    Polar Surface Area:
    70.16

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  11. ALA4790496

    Name:
    2-((1H-indol-1-yl)sulfonyl)phenol

    Mol. Formula:
    C14H11NO3S

    M.W.:
    273.31

    Type:
    Unknown

    AlogP:
    2.58

    Polar Surface Area:
    59.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  12. ALA4789112

    Name:
    2-(8-(4-nitrostyryl)-2-oxo-2H-benzo[b][1,4]oxazin-4(3H)-yl)acetic acid

    Mol. Formula:
    C18H14N2O6

    M.W.:
    354.32

    Type:
    Unknown

    AlogP:
    2.58

    Polar Surface Area:
    109.98

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  13. ALA4788090

    Name:
    2-(7-(4-hydroxy-3-methoxyphenethyl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic aciShow More

    Mol. Formula:
    C18H17NO6

    M.W.:
    343.34

    Type:
    Unknown

    AlogP:
    2.18

    Polar Surface Area:
    101.90

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  14. ALA4786411

    Name:
    2-(7-(naphthalen-1-yl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C25H17NO4

    M.W.:
    395.41

    Type:
    Unknown

    AlogP:
    5.17

    Polar Surface Area:
    72.44

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  15. ALA4784848

    Name:
    4-((1H-indol-1-yl)sulfonyl)-2-fluorophenol

    Mol. Formula:
    C14H10FNO3S

    M.W.:
    291.30

    Type:
    Unknown

    AlogP:
    2.72

    Polar Surface Area:
    59.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  16. ALA4783596

    Name:
    (E)-2-(7-(3,4-dihydroxystyryl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C17H13NO6

    M.W.:
    327.29

    Type:
    Unknown

    AlogP:
    2.26

    Polar Surface Area:
    112.90

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  17. ALA4782479

    Name:
    (E)-2-(7-(4-hydroxy-3-methoxystyryl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acShow More

    Mol. Formula:
    C18H15NO6

    M.W.:
    341.32

    Type:
    Unknown

    AlogP:
    2.56

    Polar Surface Area:
    101.90

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  18. ALA4781422

    Name:
    (E)-2-(7-(4-hydroxystyryl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C17H13NO5

    M.W.:
    311.29

    Type:
    Unknown

    AlogP:
    2.56

    Polar Surface Area:
    92.67

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  19. ALA4778351

    Name:
    (E)-2-(6-(4-hydroxystyryl)-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C17H13NO5

    M.W.:
    311.29

    Type:
    Unknown

    AlogP:
    2.56

    Polar Surface Area:
    92.67

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  20. ALA4761856

    Name:
    (E)-2-(2-oxo-6-styrylbenzo[d]oxazol-3(2H)-yl)acetic acid

    Mol. Formula:
    C17H13NO4

    M.W.:
    295.29

    Type:
    Unknown

    AlogP:
    2.85

    Polar Surface Area:
    72.44

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
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