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  1. ALA4475874

    Name:
    4-[[(1R)-1-[[4-(3-aminophenyl)phenyl]methyl]-2-car
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    Mol. Formula:
    C20H22N2O5

    M.W.:
    370.41

    Type:
    Unknown

    AlogP:
    2.30

    Polar Surface Area:
    129.72

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  2. ALA4474653

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(2-chlorophenyl)ph
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    Mol. Formula:
    C20H20ClNO5

    M.W.:
    389.84

    Type:
    Unknown

    AlogP:
    3.37

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  3. ALA4559586

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-[2-(trifluoromethy
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    Mol. Formula:
    C21H20F3NO5

    M.W.:
    423.39

    Type:
    Unknown

    AlogP:
    3.74

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  4. ALA4557208

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(m-tolyl)phenyl]et
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    Mol. Formula:
    C21H23NO5

    M.W.:
    369.42

    Type:
    Unknown

    AlogP:
    3.03

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  5. ALA4568947

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-nitrophenyl)phe
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    Mol. Formula:
    C20H20N2O7

    M.W.:
    400.39

    Type:
    Unknown

    AlogP:
    2.63

    Polar Surface Area:
    146.84

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. ALA4518426

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-ethylphenyl)phe
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    Mol. Formula:
    C22H25NO5

    M.W.:
    383.44

    Type:
    Unknown

    AlogP:
    3.28

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  7. ALA4518025

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-methoxyphenyl)p
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    Mol. Formula:
    C21H23NO6

    M.W.:
    385.42

    Type:
    Unknown

    AlogP:
    2.73

    Polar Surface Area:
    112.93

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  8. ALA4550194

    Name:
    4-[[(1R)-1-[[4-(3-acetamidophenyl)phenyl]methyl]-2
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    Mol. Formula:
    C22H24N2O6

    M.W.:
    412.44

    Type:
    Unknown

    AlogP:
    2.68

    Polar Surface Area:
    132.80

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  9. ALA4548017

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-chloro-2-methox
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    Mol. Formula:
    C21H22ClNO6

    M.W.:
    419.86

    Type:
    Unknown

    AlogP:
    3.38

    Polar Surface Area:
    112.93

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  10. ALA4547205

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-[3-(trifluoromethy
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    Mol. Formula:
    C21H20F3NO5

    M.W.:
    423.39

    Type:
    Unknown

    AlogP:
    3.74

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  11. ALA4786514

    Name:
    (R)-4,4,4-trifluoro-3-((S)-1-mercapto-3-phenylprop
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    Mol. Formula:
    C13H16F3NO2S

    M.W.:
    307.34

    Type:
    Unknown

    AlogP:
    2.52

    Polar Surface Area:
    49.33

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  12. ALA5282440

    Name:
    (S)-2-(2-((S)-2-((S)-1-((7S,10S,13S,16S,19S)-16-((
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    Mol. Formula:
    C73H115BrN22O16

    M.W.:
    1636.77

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA5278343

    Name:
    (S)-2-(2-((S)-2-((S)-1-((7S,10S,13S,16S,19S)-16-((
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    Mol. Formula:
    C101H165BrN34O20

    M.W.:
    2255.55

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. ALA5278191

    Name:
    (S)-2-(2-((S)-2-((S)-1-((7S,10S,13S,16S,19S)-16-((
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    Mol. Formula:
    C98H161BrN34O20

    M.W.:
    2215.49

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  15. ALA5286901

    Name:
    (S)-2-(2-((S)-2-((S)-1-((6S,9S,12S,15S,18S)-15-((1
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    Mol. Formula:
    C100H163BrN34O20

    M.W.:
    2241.53

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA4459630

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-chloro-5-fluoro
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    Mol. Formula:
    C20H19ClFNO5

    M.W.:
    407.83

    Type:
    Unknown

    AlogP:
    3.51

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  17. ALA4466321

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(3-cyanophenyl)phe
    Show More

    Mol. Formula:
    C21H20N2O5

    M.W.:
    380.40

    Type:
    Unknown

    AlogP:
    2.59

    Polar Surface Area:
    127.49

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  18. ALA4465277

    Name:
    4-[[(1R)-1-(carboxymethyl)-2-[4-(4-fluorophenyl)ph
    Show More

    Mol. Formula:
    C20H20FNO5

    M.W.:
    373.38

    Type:
    Unknown

    AlogP:
    2.86

    Polar Surface Area:
    103.70

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  19. ALA4098968

    Name:
    (R)-4-(1-mercaptocyclohexyl)-4-oxo-2-(4-(thiophen-
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    Mol. Formula:
    C21H24O3S2

    M.W.:
    388.55

    Type:
    Small molecule

    AlogP:
    5.25

    Polar Surface Area:
    54.37

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  20. ALA4098390

    Name:
    (S)-2-(2-((S)-2-((S)-1-((6S,9S,12S,15S,18S)-15-((1
    Show More

    Mol. Formula:
    C96H157BrN34O20

    M.W.:
    2187.43

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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