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  1. ALA4878133

    Name:
    4-(3-((4-(1H-benzo[d]imidazol-2-yl)piperidin-1-yl)
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    Mol. Formula:
    C28H26FN5O

    M.W.:
    467.55

    Type:
    Unknown

    AlogP:
    4.91

    Polar Surface Area:
    77.67

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  2. ALA4877994

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-isopentylp
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    Mol. Formula:
    C25H30N2O5

    M.W.:
    438.52

    Type:
    Unknown

    AlogP:
    3.74

    Polar Surface Area:
    97.38

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  3. ALA4877975

    Name:
    8-(3-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl)-
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    Mol. Formula:
    C31H17F3O8

    M.W.:
    574.46

    Type:
    Unknown

    AlogP:
    6.74

    Polar Surface Area:
    141.34

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  4. ALA4876971

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-(4-(triflu
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    Mol. Formula:
    C28H25F3N2O5

    M.W.:
    526.51

    Type:
    Unknown

    AlogP:
    4.91

    Polar Surface Area:
    97.38

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  5. ALA4876922

    Name:
    8-((4-(Furan-2-ylmethyl)piperazin-1-yl)methyl)-5,7
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    Mol. Formula:
    C25H24N2O6

    M.W.:
    448.48

    Type:
    Unknown

    AlogP:
    3.49

    Polar Surface Area:
    110.52

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  6. ALA4876352

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-(4-methylb
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    Mol. Formula:
    C28H28N2O5

    M.W.:
    472.54

    Type:
    Unknown

    AlogP:
    4.20

    Polar Surface Area:
    97.38

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  7. ALA4875472

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-phenyl-3,6
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    Mol. Formula:
    C27H23NO5

    M.W.:
    441.48

    Type:
    Unknown

    AlogP:
    4.87

    Polar Surface Area:
    94.14

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  8. ALA4875356

    Name:
    4-(3-(4-((2-(6-amino-4-(trifluoromethyl)pyridin-3-
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    Mol. Formula:
    C38H35F4N9O3S

    M.W.:
    773.82

    Type:
    Unknown

    AlogP:
    5.42

    Polar Surface Area:
    146.46

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    3

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  9. ALA4875196

    Name:
    8-((4-(4-Fluorobenzyl)piperazin-1-yl)methyl)-5,7-d
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    Mol. Formula:
    C27H25FN2O5

    M.W.:
    476.50

    Type:
    Unknown

    AlogP:
    4.03

    Polar Surface Area:
    97.38

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  10. ALA4874589

    Name:
    5-(4-((3-ethyl-2-oxo-1,2-dihydro-1,6-naphthyridin-
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    Mol. Formula:
    C22H26N6O2

    M.W.:
    406.49

    Type:
    Unknown

    AlogP:
    1.56

    Polar Surface Area:
    94.22

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  11. ALA4874308

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-((tetrahyd
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    Mol. Formula:
    C25H28N2O6

    M.W.:
    452.51

    Type:
    Unknown

    AlogP:
    2.87

    Polar Surface Area:
    106.61

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  12. ALA4874038

    Name:
    2-(4-((2-(1H-indazol-6-yl)-7-methyl-4-morpholinoth
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    Mol. Formula:
    C33H32N8O4S

    M.W.:
    636.74

    Type:
    Unknown

    AlogP:
    4.18

    Polar Surface Area:
    146.71

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  13. ALA4873634

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-(pyrimidin
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    Mol. Formula:
    C24H22N4O5

    M.W.:
    446.46

    Type:
    Unknown

    AlogP:
    2.69

    Polar Surface Area:
    123.16

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  14. ALA4872760

    Name:
    Methyl 1-((5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo
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    Mol. Formula:
    C23H23NO7

    M.W.:
    425.44

    Type:
    Unknown

    AlogP:
    2.96

    Polar Surface Area:
    120.44

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  15. ALA4872638

    Name:
    8-(3-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenyl)-
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    Mol. Formula:
    C28H16O9

    M.W.:
    496.43

    Type:
    Unknown

    AlogP:
    5.32

    Polar Surface Area:
    154.48

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  16. ALA4871210

    Name:
    2-(4-((2-(2-aminopyrimidin-5-yl)-4-morpholinothien
    Show More

    Mol. Formula:
    C29H29N9O4S

    M.W.:
    599.68

    Type:
    Unknown

    AlogP:
    2.37

    Polar Surface Area:
    169.83

    HBA:
    12

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  17. ALA4870960

    Name:
    4-[[4-fluoro-3-(7-methyl-3,4-dihydro-1H-pyrazino[1
    Show More

    Mol. Formula:
    C27H22FN5O2

    M.W.:
    467.50

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    83.88

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  18. ALA4870649

    Name:
    5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-((4-isobutyryl
    Show More

    Mol. Formula:
    C24H26N2O6

    M.W.:
    438.48

    Type:
    Unknown

    AlogP:
    2.88

    Polar Surface Area:
    114.45

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  19. ALA4870329

    Name:
    4-[[3-(7-chloro-3,4-dihydro-1H-pyrazino[1,2-a]benz
    Show More

    Mol. Formula:
    C26H19ClFN5O2

    M.W.:
    487.92

    Type:
    Unknown

    AlogP:
    4.31

    Polar Surface Area:
    83.88

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  20. ALA4869388

    Name:
    8-((4-(Cyclobutanecarbonyl)piperazin-1-yl)methyl)-
    Show More

    Mol. Formula:
    C25H26N2O6

    M.W.:
    450.49

    Type:
    Unknown

    AlogP:
    3.02

    Polar Surface Area:
    114.45

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
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