The page will load shortly, Thanks for your patience!
View as Grid List

Items 1-20 of 23

Set Ascending Direction
Select all
  1. ALA3337655

    Name:
    (S)-2-Amino-3-(2-(2-carboxyethyl)-4-(3-ethylureido
    Show More

    Mol. Formula:
    C15H21N3O5

    M.W.:
    323.35

    Type:
    Small molecule

    AlogP:
    0.80

    Polar Surface Area:
    141.75

    HBA:
    4

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  2. ALA3337654

    Name:
    (S)-2-Amino-3-(2-(2-carboxyethyl)-4-(phenylsulfona
    Show More

    Mol. Formula:
    C18H20N2O6S

    M.W.:
    392.43

    Type:
    Small molecule

    AlogP:
    1.46

    Polar Surface Area:
    146.79

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  3. ALA2178919

    Name:
    (S)-2-(2-(1H-Indol-3-yl)acetamido)-N1-(5-(3-(4-(3-
    Show More

    Cas Number:
    114355-41-8

    Mol. Formula:
    C29H48N8O4

    M.W.:
    572.76

    Type:
    Small molecule

    AlogP:
    0.17

    Polar Surface Area:
    196.26

    HBA:
    7

    HBD:
    8

    #RO5 Violations:
    2

    #Rotatable Bonds:
    23

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  4. ALA2178918

    Name:
    (S)-N1-((6S,12S)-1,6-Diamino-1-imino-12-methyl-7,1
    Show More

    Mol. Formula:
    C35H60N12O9

    M.W.:
    792.94

    Type:
    Small molecule

    AlogP:
    -3.51

    Polar Surface Area:
    358.10

    HBA:
    12

    HBD:
    14

    #RO5 Violations:
    3

    #Rotatable Bonds:
    29

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  5. ALA2178917

    Name:
    (S)-N1-((S)-1,6-diamino-1-imino-7,16-dioxo-2,8,13,
    Show More

    Cas Number:
    107288-22-2

    Mol. Formula:
    C30H52N10O7

    M.W.:
    664.81

    Type:
    Small molecule

    AlogP:
    -2.13

    Polar Surface Area:
    299.90

    HBA:
    10

    HBD:
    12

    #RO5 Violations:
    2

    #Rotatable Bonds:
    25

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  6. ALA596017

    Name:
    (RS)-5'-(2-Amino-2-carboxyethyl)-2',3'-dichlorobip
    Show More

    Mol. Formula:
    C16H13Cl2NO4

    M.W.:
    354.19

    Type:
    Small molecule

    AlogP:
    3.31

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  7. ALA602590

    Name:
    (RS)-2-Amino-3-(30-(carboxymethyl)biphenyl-3-yl)pr
    Show More

    Mol. Formula:
    C17H17NO4

    M.W.:
    299.33

    Type:
    Small molecule

    AlogP:
    1.94

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  8. ALA609876

    Name:
    (RS)-3'-(2-Amino-2-carboxyethyl)biphenyl-3-carboxy
    Show More

    Mol. Formula:
    C16H15NO4

    M.W.:
    285.30

    Type:
    Small molecule

    AlogP:
    2.01

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  9. ALA594637

    Name:
    (R)-30-(2-Amino-2-carboxyethyl)biphenyl-3-carboxyl
    Show More

    Mol. Formula:
    C16H15NO4

    M.W.:
    285.30

    Type:
    Small molecule

    AlogP:
    2.01

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  10. ALA594636

    Name:
    (S)-30-(2-Amino-2-carboxyethyl)biphenyl-3-carboxyl
    Show More

    Mol. Formula:
    C16H15NO4

    M.W.:
    285.30

    Type:
    Small molecule

    AlogP:
    2.01

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  11. ALA608107

    Name:
    (RS)-4-(3-(2-Amino-2-carboxyethyl)benzyl)benzoic a
    Show More

    Mol. Formula:
    C17H17NO4

    M.W.:
    299.33

    Type:
    Small molecule

    AlogP:
    1.93

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  12. ALA594842

    Name:
    (RS)-2-(3-(2-Amino-2-carboxyethyl)benzyl)benzoic a
    Show More

    Mol. Formula:
    C17H17NO4

    M.W.:
    299.33

    Type:
    Small molecule

    AlogP:
    1.93

    Polar Surface Area:
    100.62

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  13. ALA594617

    Name:
    (RS)-2-Amino-3-(5,6-dichloro-3'-(1H-tetrazol-5-yl)
    Show More

    Mol. Formula:
    C16H13Cl2N5O2

    M.W.:
    378.22

    Type:
    Small molecule

    AlogP:
    2.79

    Polar Surface Area:
    117.78

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  14. ALA594840

    Name:
    (S)-2-amino-3-[5-tertbutyl-3-(phosphono-methoxy)-4
    Show More

    Mol. Formula:
    C11H19N2O7P

    M.W.:
    322.25

    Type:
    Small molecule

    AlogP:
    0.44

    Polar Surface Area:
    156.11

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  15. ALA220509

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-3-(2-carboxyfuran-3
    Show More

    Mol. Formula:
    C14H15N3O7

    M.W.:
    337.29

    Type:
    Small molecule

    AlogP:
    -0.93

    Polar Surface Area:
    157.76

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  16. ALA220822

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-3-(2-carboxy-4,5-di
    Show More

    Cas Number:
    936095-51-1

    Mol. Formula:
    C14H13Br2N3O6S

    M.W.:
    511.15

    Type:
    Small molecule

    AlogP:
    1.06

    Polar Surface Area:
    144.62

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  17. ALA221321

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-5-bromo-3-(2-carbox
    Show More

    Mol. Formula:
    C13H12BrN3O6S

    M.W.:
    418.23

    Type:
    Small molecule

    AlogP:
    -0.01

    Polar Surface Area:
    144.62

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  18. ALA374553

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-5-bromo-3-(2-carbox
    Show More

    Mol. Formula:
    C15H14BrN3O6

    M.W.:
    412.20

    Type:
    Small molecule

    AlogP:
    -0.07

    Polar Surface Area:
    144.62

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  19. ALA223841

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)
    Show More

    Mol. Formula:
    C15H14FN3O6

    M.W.:
    351.29

    Type:
    Small molecule

    AlogP:
    -0.69

    Polar Surface Area:
    144.62

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  20. ALA222521

    Name:
    (S)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)
    Show More

    Mol. Formula:
    C16H17N3O6

    M.W.:
    347.33

    Type:
    Small molecule

    AlogP:
    -0.52

    Polar Surface Area:
    144.62

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
Page
per page