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  1. ALA4513688

    Name:
    1-(4,5-Bis(4-(furan-3-yl)phenyl)thiophen-2-yl)-N-(
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    Mol. Formula:
    C31H30N2O2S

    M.W.:
    494.66

    Type:
    Unknown

    AlogP:
    7.69

    Polar Surface Area:
    50.34

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  2. ALA4513653

    Name:
    1-((S)-2',4'-Dioxo-3'-(2-oxo-2-((S)-3-(trifluorome
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    Mol. Formula:
    C26H25F3N4O5

    M.W.:
    530.50

    Type:
    Unknown

    AlogP:
    3.46

    Polar Surface Area:
    108.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  3. ALA4513369

    Name:
    4-(5-(4,5-Dimethyl-2-nitrobenzoyl)-1H-indol-1-yl)b
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    Mol. Formula:
    C24H18N2O5

    M.W.:
    414.42

    Type:
    Unknown

    AlogP:
    5.08

    Polar Surface Area:
    102.44

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  4. ALA4483638

    Name:
    1-(4,5-Bis(4-isopropylphenyl)thiophen-2-yl)-N-(pip
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    Mol. Formula:
    C29H38N2S

    M.W.:
    446.70

    Type:
    Unknown

    AlogP:
    7.42

    Polar Surface Area:
    24.06

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  5. ALA4475351

    Name:
    1-((R)-3'-(2-((S)-3-Cyclopropyl-7-fluoro-1,3,4,5-t
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    Mol. Formula:
    C28H29FN4O5

    M.W.:
    520.56

    Type:
    Unknown

    AlogP:
    3.45

    Polar Surface Area:
    108.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  6. ALA4474848

    Name:
    4-(3-Methyl-5-oxo-4-((5-(3-oxo-2,3-dihydro-1H-inde
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    Mol. Formula:
    C25H18N2O5

    M.W.:
    426.43

    Type:
    Unknown

    AlogP:
    4.58

    Polar Surface Area:
    100.18

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  7. ALA4474132

    Name:
    1-(4,5-Bis(4-(tert-butyl)phenyl)thiophen-2-yl)-N-(
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    Mol. Formula:
    C31H42N2S

    M.W.:
    474.76

    Type:
    Unknown

    AlogP:
    7.77

    Polar Surface Area:
    24.06

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  8. ALA4474109

    Name:
    (R)-3'-(2-((R)-3-Cyclopropyl-7-fluoro-2,3-dihydrob
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    Mol. Formula:
    C29H27FN4O5

    M.W.:
    530.56

    Type:
    Unknown

    AlogP:
    3.55

    Polar Surface Area:
    93.97

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  9. ALA4538233

    Name:
    10-Benzyloxy-2,3,11-trimethoxy-6,7-dihydro-5H-benz
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    Mol. Formula:
    C28H28ClNO4

    M.W.:
    477.99

    Type:
    Unknown

    AlogP:
    5.35

    Polar Surface Area:
    40.80

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  10. ALA4537592

    Name:
    4-(4-(1-(5-(4,5-Dimethyl-2-nitrophenyl)furan-2-yl)
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    Mol. Formula:
    C25H21N3O6

    M.W.:
    459.46

    Type:
    Unknown

    AlogP:
    5.37

    Polar Surface Area:
    126.25

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  11. ALA4536287

    Name:
    8-Benzyl-2,3,10,11-tetramethoxy-5,6,7,9,14,14a-hex
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    Mol. Formula:
    C29H34BrNO4

    M.W.:
    540.50

    Type:
    Unknown

    AlogP:
    5.48

    Polar Surface Area:
    36.92

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  12. ALA4525368

    Name:
    1-Methyl-3-((R)-3'-(2-((S)-3-methyl-1,3,4,5-tetrah
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    Mol. Formula:
    C26H28N4O5

    M.W.:
    476.53

    Type:
    Unknown

    AlogP:
    2.92

    Polar Surface Area:
    108.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  13. ALA4524766

    Name:
    (S)-2-((S)-3-carboxy-5-((S)-1-carboxy-3-(5-(((S)-5
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    Mol. Formula:
    C29H37N7O15

    M.W.:
    723.65

    Type:
    Unknown

    AlogP:
    -3.41

    Polar Surface Area:
    377.19

    HBA:
    12

    HBD:
    13

    #RO5 Violations:
    3

    #Rotatable Bonds:
    20

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  14. ALA4524475

    Name:
    (6S,9S,12S,15S)-1-amino-6-((3S,6S,9S,E)-9-(carboxy
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    Mol. Formula:
    C42H71N13O13

    M.W.:
    966.11

    Type:
    Unknown

    AlogP:
    -3.89

    Polar Surface Area:
    429.62

    HBA:
    13

    HBD:
    14

    #RO5 Violations:
    3

    #Rotatable Bonds:
    25

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  15. ALA4524352

    Name:
    1-Methyl-3-((R)-3'-(2-((R)-3-methyl-1,3,4,5-tetrah
    Show More

    Mol. Formula:
    C26H28N4O5

    M.W.:
    476.53

    Type:
    Unknown

    AlogP:
    2.92

    Polar Surface Area:
    108.05

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  16. ALA4522651

    Name:
    4-(5-((5-(4,5-Dimethyl-2-nitrophenyl)furan-2-yl)me
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    Mol. Formula:
    C23H16N2O7S

    M.W.:
    464.46

    Type:
    Unknown

    AlogP:
    5.41

    Polar Surface Area:
    130.96

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  17. ALA4522123

    Name:
    N-((5,6-Bis(4-(furan-3-yl)phenyl)pyrazin-2-yl)meth
    Show More

    Mol. Formula:
    C31H30N4O2

    M.W.:
    490.61

    Type:
    Unknown

    AlogP:
    6.42

    Polar Surface Area:
    76.12

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  18. ALA4520507

    Name:
    1-(4,5-Bis(4-butylphenyl)thiophen-2-yl)-N-(piperid
    Show More

    Mol. Formula:
    C31H42N2S

    M.W.:
    474.76

    Type:
    Unknown

    AlogP:
    7.86

    Polar Surface Area:
    24.06

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  19. Type:
    Unknown

    AlogP:
    3.63

    Polar Surface Area:
    62.55

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  20. ALA4535532

    Name:
    1-(4,5-Bis(4-(tert-butyl)phenyl)thiazol-2-yl)-N-(p
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    Mol. Formula:
    C30H41N3S

    M.W.:
    475.75

    Type:
    Unknown

    AlogP:
    7.16

    Polar Surface Area:
    36.95

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
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