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  1. ALA5285512

    Name:
    6-methoxy-1-(1-methylindol-3-yl)-9H-pyrido[3,4-b]i
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    Mol. Formula:
    C21H17N3O

    M.W.:
    327.39

    Type:
    ---

    AlogP:
    4.88

    Polar Surface Area:
    42.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  2. ALA5280298

    Name:
    1-(2-naphthyl)-9H-pyrido[3,4-b]indole

    Mol. Formula:
    C21H14N2

    M.W.:
    294.36

    Type:
    ---

    AlogP:
    5.54

    Polar Surface Area:
    28.68

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  3. ALA5268604

    Name:
    1-(1H-indol-3-yl)-9H-pyrido[3,4-b]indol-6-ol

    Mol. Formula:
    C19H13N3O

    M.W.:
    299.33

    Type:
    ---

    AlogP:
    4.57

    Polar Surface Area:
    64.70

    HBA:
    2

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  4. ALA5094012

    Name:
    (4R)-4-[[(5-chloro-8-quinolyl)methylamino]methyl]-
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    Mol. Formula:
    C18H20ClN3O

    M.W.:
    329.83

    Type:
    Unknown

    AlogP:
    2.99

    Polar Surface Area:
    45.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.92

    DETAILS
  5. ALA5093969

    Name:
    N-[(5-chloro-8-quinolyl)methyl]-2-[(3R)-tetrahydro
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    Mol. Formula:
    C16H19ClN2O

    M.W.:
    290.79

    Type:
    Unknown

    AlogP:
    3.40

    Polar Surface Area:
    34.15

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  6. ALA5093652

    Name:
    1-phenyl-4-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)
    Show More

    Mol. Formula:
    C21H23N5

    M.W.:
    345.45

    Type:
    Unknown

    AlogP:
    3.27

    Polar Surface Area:
    66.01

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  7. ALA5093295

    Name:
    1-(5-chloro-8-quinolyl)-N-[[(7S)-5,6,7,8-tetrahydr
    Show More

    Mol. Formula:
    C18H19ClN4

    M.W.:
    326.83

    Type:
    Unknown

    AlogP:
    3.44

    Polar Surface Area:
    42.74

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  8. ALA5092728

    Name:
    (2R)-1-(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-
    Show More

    Mol. Formula:
    C21H33NO3

    M.W.:
    347.50

    Type:
    Unknown

    AlogP:
    2.90

    Polar Surface Area:
    41.93

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.89

    DETAILS
  9. ALA5092524

    Name:
    2-[(5-fluoro-8-quinolyl)methylamino]-N,N-dimethyl-
    Show More

    Mol. Formula:
    C14H18FN3O2S

    M.W.:
    311.38

    Type:
    Unknown

    AlogP:
    1.35

    Polar Surface Area:
    62.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  10. ALA5091270

    Name:
    N-[[(3S)-1,1-dioxothian-3-yl]methyl]-1-(8-quinolyl
    Show More

    Mol. Formula:
    C16H20N2O2S

    M.W.:
    304.42

    Type:
    Unknown

    AlogP:
    2.15

    Polar Surface Area:
    59.06

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.94

    DETAILS
  11. ALA5090584

    Name:
    N,N-dimethyl-2-(8-quinolylmethylamino)ethanesulfon
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    Mol. Formula:
    C14H19N3O2S

    M.W.:
    293.39

    Type:
    Unknown

    AlogP:
    1.22

    Polar Surface Area:
    62.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  12. ALA5089996

    Name:
    (4S)-4-[[(5-chloro-8-quinolyl)methylamino]methyl]-
    Show More

    Mol. Formula:
    C17H20ClN3O

    M.W.:
    317.82

    Type:
    Unknown

    AlogP:
    2.85

    Polar Surface Area:
    45.23

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.94

    DETAILS
  13. ALA5087602

    Name:
    1-(5-bromo-8-quinolyl)-N-[(1-methylsulfonylcyclopr
    Show More

    Mol. Formula:
    C15H17BrN2O2S

    M.W.:
    369.28

    Type:
    Unknown

    AlogP:
    2.66

    Polar Surface Area:
    59.06

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  14. ALA5087322

    Name:
    N2-[(2-imidazol-1-ylphenyl)methyl]-N4,N4,5-trimeth
    Show More

    Mol. Formula:
    C17H20N6

    M.W.:
    308.39

    Type:
    Unknown

    AlogP:
    2.65

    Polar Surface Area:
    58.87

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  15. ALA5085238

    Name:
    N-[[(3S)-1,1-dioxothiolan-3-yl]methyl]-1-(8-quinol
    Show More

    Mol. Formula:
    C15H18N2O2S

    M.W.:
    290.39

    Type:
    Unknown

    AlogP:
    1.76

    Polar Surface Area:
    59.06

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  16. ALA5082151

    Name:
    2-[(5-chloro-8-quinolyl)methylamino]-N,N-dimethyl-
    Show More

    Mol. Formula:
    C14H18ClN3O2S

    M.W.:
    327.84

    Type:
    Unknown

    AlogP:
    1.87

    Polar Surface Area:
    62.30

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  17. ALA5079273

    Name:
    N-[(5-chloro-8-quinolyl)methyl]-2-(3-pyridyl)ethan
    Show More

    Mol. Formula:
    C17H16ClN3

    M.W.:
    297.79

    Type:
    Unknown

    AlogP:
    3.62

    Polar Surface Area:
    37.81

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  18. ALA5075486

    Name:
    1-(5-chloro-8-quinolyl)-N-[[(3S)-1,1-dioxothian-3-
    Show More

    Mol. Formula:
    C16H19ClN2O2S

    M.W.:
    338.86

    Type:
    Unknown

    AlogP:
    2.80

    Polar Surface Area:
    59.06

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  19. ALA5074821

    Name:
    (2S)-1-(4-methylpyrazol-1-yl)-N-[[3-(2-pyridylmeth
    Show More

    Mol. Formula:
    C20H24N4O

    M.W.:
    336.44

    Type:
    Unknown

    AlogP:
    3.34

    Polar Surface Area:
    51.97

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  20. ALA3654214

    Name:
    US8962612, 86

    Mol. Formula:
    C19H18F2N4O

    M.W.:
    356.38

    Type:
    Small molecule

    AlogP:
    2.87

    Polar Surface Area:
    84.71

    HBA:
    1

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
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