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  1. ALA4513930

    Name:
    (+/-)-1-ethyl-2-methyl-2,3-dihydro-1H-benzo[f]chro
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    Mol. Formula:
    C16H19NO

    M.W.:
    241.33

    Type:
    Unknown

    AlogP:
    3.44

    Polar Surface Area:
    35.25

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  2. ALA4513458

    Name:
    N-{5-[5-Methoxy-1-(naphthalene-1-sulfonyl)-1H-indo
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    Mol. Formula:
    C26H24N4O4S

    M.W.:
    488.57

    Type:
    Unknown

    AlogP:
    5.09

    Polar Surface Area:
    106.08

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  3. ALA4483687

    Name:
    2-[4-(4-Benzylpiperidin-1-yl)butyl][1]benzothieno[
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    Mol. Formula:
    C26H29N3OS

    M.W.:
    431.61

    Type:
    Unknown

    AlogP:
    5.42

    Polar Surface Area:
    48.99

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  4. ALA4483304

    Name:
    N-{5-[1-(Benzenesulfonyl)-1H-indol-6-yl]-4-methyl-
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    Mol. Formula:
    C21H20N4O3S

    M.W.:
    408.48

    Type:
    Unknown

    AlogP:
    3.93

    Polar Surface Area:
    96.85

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  5. ALA4476520

    Name:
    3-(1-Ethyl-1H-imidazol-5-yl)-5-(trifluoromethoxy)-
    Show More

    Mol. Formula:
    C14H12F3N3O

    M.W.:
    295.26

    Type:
    Unknown

    AlogP:
    3.95

    Polar Surface Area:
    42.84

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  6. ALA4476396

    Name:
    (+/-)-3a,8-dimethyl-5-p-tolyl-2,3,3a,4,5,9b-hexahy
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    Mol. Formula:
    C20H24N2

    M.W.:
    292.43

    Type:
    Unknown

    AlogP:
    4.29

    Polar Surface Area:
    15.27

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  7. ALA4476372

    Name:
    5-Chloro-3-(1-ethyl-1H-imidazol-5-yl)-4-fluoro-1H-
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    Mol. Formula:
    C13H11ClFN3

    M.W.:
    263.70

    Type:
    Unknown

    AlogP:
    3.84

    Polar Surface Area:
    33.61

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  8. ALA4476294

    Name:
    3-(4-(3-(5-fluoro-1H-indol-3-yl)propyl)piperazin-1
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    Mol. Formula:
    C22H23FN4S

    M.W.:
    394.52

    Type:
    Unknown

    AlogP:
    4.67

    Polar Surface Area:
    35.16

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  9. ALA4476164

    Name:
    2-[4-[3-(1H-indol-3-yl)-1-piperidyl]butyl]-4-pheny
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    Mol. Formula:
    C31H36N4O2

    M.W.:
    496.66

    Type:
    Unknown

    AlogP:
    5.15

    Polar Surface Area:
    63.03

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  10. ALA4475894

    Name:
    2-[[3-(4-Phenylpiperazin-1-yl)propyl]sulfanyl][1]b
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    Mol. Formula:
    C23H24N4OS2

    M.W.:
    436.61

    Type:
    Unknown

    AlogP:
    4.44

    Polar Surface Area:
    52.23

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  11. ALA4475730

    Name:
    4-(4-chlorophenyl)-2-[4-[3-(5-methoxy-1H-indol-3-y
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    Mol. Formula:
    C32H37ClN4O3

    M.W.:
    561.13

    Type:
    Unknown

    AlogP:
    5.82

    Polar Surface Area:
    72.26

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  12. ALA4474829

    Name:
    N-(4-methyl-5-(1-(naphthalen-1-ylsulfonyl)-1H-indo
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    Mol. Formula:
    C25H22N4O3S

    M.W.:
    458.54

    Type:
    Unknown

    AlogP:
    5.08

    Polar Surface Area:
    96.85

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  13. ALA4537701

    Name:
    N-(5-(5-fluoro-1-(phenylsulfonyl)-1H-indol-3-yl)-4
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    Mol. Formula:
    C21H19FN4O3S

    M.W.:
    426.47

    Type:
    Unknown

    AlogP:
    4.06

    Polar Surface Area:
    96.85

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  14. ALA4524906

    Name:
    1-{3-[1-(Benzenesulfonyl)-1H-indol-3-yl]-2-methyl-
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    Mol. Formula:
    C23H22N4O3S

    M.W.:
    434.52

    Type:
    Unknown

    AlogP:
    3.81

    Polar Surface Area:
    77.20

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  15. ALA4521199

    Name:
    N-(5-(1-(3-fluorophenylsulfonyl)-5-methoxy-1H-indo
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    Mol. Formula:
    C21H19FN4O4S

    M.W.:
    442.47

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    106.08

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  16. ALA4520003

    Name:
    N-benzyl-5-(5-methoxy-1-(phenylsulfonyl)-1H-indol-
    Show More

    Mol. Formula:
    C26H24N4O3S

    M.W.:
    472.57

    Type:
    Unknown

    AlogP:
    5.20

    Polar Surface Area:
    89.01

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  17. ALA4534493

    Name:
    N-octyl-3-(3,4,5-trimethoxyphenyl)acrylamide

    Mol. Formula:
    C20H31NO4

    M.W.:
    349.47

    Type:
    Unknown

    AlogP:
    4.20

    Polar Surface Area:
    56.79

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  18. ALA4533362

    Name:
    2-[4-[3-(5-fluoro-1H-indol-3-yl)-1-piperidyl]butyl
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    Mol. Formula:
    C32H37FN4O3

    M.W.:
    544.67

    Type:
    Unknown

    AlogP:
    5.30

    Polar Surface Area:
    72.26

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  19. ALA4532185

    Name:
    Uncarialin D

    Mol. Formula:
    C22H26N2O5

    M.W.:
    398.46

    Type:
    Unknown

    AlogP:
    2.41

    Polar Surface Area:
    77.10

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  20. ALA4531898

    Name:
    5-chloro-3-(1-ethyl-1H-imidazol-5-yl)-6-fluoro-1H-
    Show More

    Mol. Formula:
    C13H11ClFN3

    M.W.:
    263.70

    Type:
    Unknown

    AlogP:
    3.84

    Polar Surface Area:
    33.61

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
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