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  1. ALA5280080

    Name:
    (E)-2-((5-((5-ethylfuran-2-yl)methylene)-4-oxo-4,5
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    Mol. Formula:
    C18H15FN2O4S

    M.W.:
    374.39

    Type:
    ---

    AlogP:
    3.37

    Polar Surface Area:
    91.90

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  2. ALA5279984

    Name:
    (Z)-2-((5-((5-ethylfuran-2-yl)methylene)-4-oxo-4,5
    Show More

    Mol. Formula:
    C18H15FN2O4S

    M.W.:
    374.39

    Type:
    ---

    AlogP:
    3.37

    Polar Surface Area:
    91.90

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  3. ALA2296936

    Name:
    2-(4-((4-carbamoyl-4'-chlorobiphenyl-2-yl)methoxy)
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    Mol. Formula:
    C34H29ClFN3O4

    M.W.:
    598.07

    Type:
    Small molecule

    AlogP:
    8.04

    Polar Surface Area:
    107.44

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  4. ALA2296935

    Name:
    2-(4-((4-(acetylcarbamoyl)-4'-chlorobiphenyl-2-yl)
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    Mol. Formula:
    C36H31ClFN3O5

    M.W.:
    640.11

    Type:
    Small molecule

    AlogP:
    8.22

    Polar Surface Area:
    110.52

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  5. ALA2296656

    Name:
    2-(4-((4-(4-chlorophenyl)-2-methylpyrimidin-5-yl)m
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    Mol. Formula:
    C32H28ClFN4O3

    M.W.:
    571.05

    Type:
    Small molecule

    AlogP:
    8.04

    Polar Surface Area:
    90.13

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  6. ALA4548919

    Name:
    (4-(N-(5-Cyclopropyl-2-(4-fluorophenyl)-3-(methylc
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    Mol. Formula:
    C26H23BF2N2O6S

    M.W.:
    540.35

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA4547789

    Name:
    5-(3-Chloro-4-methoxy-5-((1-(pyrimidin-2-yl)cyclop
    Show More

    Mol. Formula:
    C34H31ClFN5O6S

    M.W.:
    692.17

    Type:
    Unknown

    AlogP:
    5.92

    Polar Surface Area:
    143.73

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  8. ALA4546969

    Name:
    7-(4-Methoxybenzylidene)-3,4-dihydro-3-(4-methoxyp
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    Mol. Formula:
    C20H19N3O3S

    M.W.:
    381.46

    Type:
    Unknown

    AlogP:
    1.81

    Polar Surface Area:
    56.06

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  9. ALA4546966

    Name:
    6-(N-ethylacetamido)-2-(4-fluorophenyl)-5-(4-metho
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    Mol. Formula:
    C35H32FN5O5

    M.W.:
    621.67

    Type:
    Unknown

    AlogP:
    5.86

    Polar Surface Area:
    126.66

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  10. ALA4546784

    Name:
    2-(4-fluorophenyl)-N-methyl-5-(3-(1-(pyridin-2-yl)
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    Mol. Formula:
    C31H24FN3O3

    M.W.:
    505.55

    Type:
    Unknown

    AlogP:
    6.08

    Polar Surface Area:
    84.23

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  11. ALA4549638

    Name:
    6-(N-ethylmethylsulfonamido)-2-(4-fluorophenyl)-N-
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    Mol. Formula:
    C33H30FN5O5S

    M.W.:
    627.70

    Type:
    Unknown

    AlogP:
    5.26

    Polar Surface Area:
    134.50

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  12. ALA5272023

    Name:
    (Z)-5-(4-bromobenzylidene)-3-((phenylsulfonyl)meth
    Show More

    Mol. Formula:
    C17H12BrNO3S3

    M.W.:
    454.39

    Type:
    ---

    AlogP:
    4.08

    Polar Surface Area:
    54.45

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  13. ALA4560888

    Name:
    7-(4-Fluorobenzylidene)-3,4-dihydro-3-phenyl-2H-th
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    Mol. Formula:
    C18H14FN3OS

    M.W.:
    339.40

    Type:
    Unknown

    AlogP:
    1.93

    Polar Surface Area:
    37.60

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  14. ALA4558013

    Name:
    (2S,4S,5R)-1-(4-(tert-butyl)-3-methoxybenzoyl)-2-i
    Show More

    Mol. Formula:
    C26H37NO8

    M.W.:
    491.58

    Type:
    Unknown

    AlogP:
    3.87

    Polar Surface Area:
    111.60

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  15. ALA4555125

    Name:
    7-(4-Methoxybenzylidene)-3-(4-chlorophenyl)-3,4-di
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    Mol. Formula:
    C19H16ClN3O2S

    M.W.:
    385.88

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    46.83

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  16. ALA4554477

    Name:
    2-(5-(4-Methoxybenzylidene)-2,4-dioxothiazolidin-3
    Show More

    Mol. Formula:
    C20H18N2O5S

    M.W.:
    398.44

    Type:
    Unknown

    AlogP:
    3.38

    Polar Surface Area:
    84.94

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  17. ALA4554145

    Name:
    2-(5-(4-Fluorobenzylidene)-2,4-dioxothiazolidin-3-
    Show More

    Mol. Formula:
    C18H12ClFN2O3S

    M.W.:
    390.82

    Type:
    Unknown

    AlogP:
    4.15

    Polar Surface Area:
    66.48

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  18. ALA4551328

    Name:
    (2S,4S,5R)-1-(4-(tert-butyl)-3-methoxybenzoyl)-5-(
    Show More

    Mol. Formula:
    C29H40N2O7S

    M.W.:
    560.71

    Type:
    Unknown

    AlogP:
    5.35

    Polar Surface Area:
    115.26

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  19. ALA4540766

    Name:
    (2S)-isopropyl 2-((((2R,3R,4S,5R)-5-(6-amino-9H-pu
    Show More

    Mol. Formula:
    C22H27BrFN6O8P

    M.W.:
    633.37

    Type:
    Unknown

    AlogP:
    2.15

    Polar Surface Area:
    192.91

    HBA:
    12

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  20. ALA4537114

    Name:
    (4-(N-(5-Cyclopropyl-2-(4-fluorophenyl)-3-(methylc
    Show More

    Mol. Formula:
    C27H23BF4N2O6S

    M.W.:
    590.36

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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