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  1. ALA4795575

    Name:
    NA

    Mol. Formula:
    C29H31N3O4

    M.W.:
    485.58

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    87.72

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  2. ALA4793039

    Name:
    NA

    Mol. Formula:
    C28H36N6O5

    M.W.:
    536.63

    Type:
    Unknown

    AlogP:
    1.60

    Polar Surface Area:
    153.60

    HBA:
    10

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  3. ALA4780505

    Name:
    NA

    Mol. Formula:
    C29H32BrN3O4

    M.W.:
    566.50

    Type:
    Unknown

    AlogP:
    5.09

    Polar Surface Area:
    98.58

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  4. ALA4758081

    Name:
    NA

    Mol. Formula:
    C37H42N2O6

    M.W.:
    610.75

    Type:
    Unknown

    AlogP:
    5.37

    Polar Surface Area:
    77.54

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  5. ALA4757200

    Name:
    NA

    Mol. Formula:
    C29H31N3O4

    M.W.:
    485.58

    Type:
    Unknown

    AlogP:
    4.11

    Polar Surface Area:
    87.72

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. ALA4756430

    Name:
    NA

    Mol. Formula:
    C26H30N4O5

    M.W.:
    478.55

    Type:
    Unknown

    AlogP:
    2.06

    Polar Surface Area:
    105.09

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  7. ALA4744046

    Name:
    NA

    Mol. Formula:
    C30H31ClN6O3

    M.W.:
    559.07

    Type:
    Unknown

    AlogP:
    4.73

    Polar Surface Area:
    120.06

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  8. ALA4641964

    Name:
    2-(2,4-dimethoxyphenyl)-N-(2-morpholinoethyl)imidazo[1,2-a]pyridin-3-amine

    Mol. Formula:
    C21H26N4O3

    M.W.:
    382.46

    Type:
    Unknown

    AlogP:
    2.76

    Polar Surface Area:
    60.26

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  9. ALA4218360

    Name:
    N-(3-Chlorobenzyl)-2-(2-chloro-5-fluorophenoxy)ethanamine hydrochloride

    Mol. Formula:
    C15H15Cl3FNO

    M.W.:
    350.65

    Type:
    Small molecule

    AlogP:
    4.30

    Polar Surface Area:
    21.26

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  10. ALA4218307

    Name:
    N4-[2-(2,5-difluorophenoxy)ethyl]-N6-methyl-3,4-dihydro-2H-thiochromene-4,6Show More

    Mol. Formula:
    C18H21ClF2N2O3S

    M.W.:
    418.89

    Type:
    Small molecule

    AlogP:
    2.89

    Polar Surface Area:
    67.43

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  11. ALA4214499

    Name:
    2-(2-Chloro-5-fluorophenoxy)-N-{2-[2-(methylsulfonyl)phenyl]ethyl}ethanaminShow More

    Mol. Formula:
    C17H19ClFNO3S

    M.W.:
    371.86

    Type:
    Small molecule

    AlogP:
    3.09

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  12. ALA4213993

    Name:
    2-(2-Chloro-5-fluorophenoxy)-N-[2-(methylsulfonyl)benzyl]ethanamine hydrochShow More

    Mol. Formula:
    C16H18Cl2FNO3S

    M.W.:
    394.30

    Type:
    Small molecule

    AlogP:
    3.05

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  13. ALA4213747

    Name:
    2-(2-Chloro-5-fluorophenoxy)-N-[5-chloro-2-(methylsulfonyl)benzyl]ethanaminShow More

    Mol. Formula:
    C16H17Cl3FNO3S

    M.W.:
    428.74

    Type:
    Small molecule

    AlogP:
    3.70

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  14. ALA4210954

    Name:
    (R)-N4-[2-(2,5-difluorophenoxy)ethyl]-N6-methyl-3,4-dihydro-2H-thiochromeneShow More

    Mol. Formula:
    C18H21ClF2N2O3S

    M.W.:
    418.89

    Type:
    Small molecule

    AlogP:
    2.89

    Polar Surface Area:
    67.43

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  15. ALA4210106

    Name:
    N-[2-(2-Chloro-5-fluorophenoxy)ethyl]-1-[2-(methylsulfonyl)phenyl]ethanaminShow More

    Mol. Formula:
    C17H20Cl2FNO3S

    M.W.:
    408.32

    Type:
    Small molecule

    AlogP:
    3.61

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  16. ALA4209590

    Name:
    N-[2-(2-chloro-5-fluorophenoxy)ethyl]-3-[2-(methylsulfonyl)phenyl]propan-1-Show More

    Mol. Formula:
    C18H21ClFNO3S

    M.W.:
    385.89

    Type:
    Small molecule

    AlogP:
    3.48

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  17. ALA4205740

    Name:
    N-[2-(2-Chloro-5-fluorophenoxy)ethyl]-3,4-dihydro-2Hthiochromen-4-amine 1,1Show More

    Mol. Formula:
    C17H18Cl2FNO3S

    M.W.:
    406.31

    Type:
    Small molecule

    AlogP:
    3.37

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  18. ALA4205209

    Name:
    N-[2-(2-Chloro-5-fluorophenoxy)ethyl]-2,3-dihydro-1-benzothiophen-3-amine 1Show More

    Mol. Formula:
    C16H16Cl2FNO3S

    M.W.:
    392.28

    Type:
    Small molecule

    AlogP:
    2.98

    Polar Surface Area:
    55.40

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  19. ALA3809314

    Name:
    (S)-1-(3-Hydroxypropyl)-5-(2-((2-(5-methyl-2-(2,2,2-trifluoroethoxy)phenoxyShow More

    Mol. Formula:
    C26H32F3N3O4

    M.W.:
    507.55

    Type:
    Small molecule

    AlogP:
    3.97

    Polar Surface Area:
    98.74

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  20. ALA3809490

    Name:
    (R)-1-(3-Hydroxypropyl)-5-(2-((2-(5-methyl-2-(2,2,2-trifluoroethoxy)phenoxyShow More

    Mol. Formula:
    C26H32F3N3O4

    M.W.:
    507.55

    Type:
    Small molecule

    AlogP:
    3.97

    Polar Surface Area:
    98.74

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
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