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

Items 1-20 of 84

Set Ascending Direction
Select all
  1. ALA4537884

    Name:
    Stachyonic acid A

    Mol. Formula:
    C20H30O2

    M.W.:
    302.46

    Type:
    Unknown

    AlogP:
    5.37

    Polar Surface Area:
    37.30

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  2. Type:
    Unknown

    AlogP:
    3.58

    Polar Surface Area:
    44.81

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  3. ALA4743114

    Name:
    2-ethylbutyl((2-((4-(2-amino-4-methoxypyrimidin-5-
    Show More

    Mol. Formula:
    C27H38N5O8P

    M.W.:
    591.60

    Type:
    Unknown

    AlogP:
    4.49

    Polar Surface Area:
    145.15

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  4. ALA4779852

    Name:
    2-ethylbutyl((2-((4-(2,4-dimethoxypyrimidin-5-yl)-
    Show More

    Mol. Formula:
    C26H37N6O7P

    M.W.:
    576.59

    Type:
    Unknown

    AlogP:
    4.07

    Polar Surface Area:
    161.94

    HBA:
    12

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  5. ALA4782838

    Name:
    2-((4-(2,4-dimethoxypyrimidine-5-yl)-1H-imidazol-1
    Show More

    Mol. Formula:
    C12H16N4O4

    M.W.:
    280.28

    Type:
    Unknown

    AlogP:
    0.32

    Polar Surface Area:
    91.52

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  6. ALA4796361

    Name:
    2-((4-(2-amino-4-methoxypyrimidin-5-yl)-1Himidazol
    Show More

    Mol. Formula:
    C11H15N5O3

    M.W.:
    265.27

    Type:
    Unknown

    AlogP:
    -0.10

    Polar Surface Area:
    108.31

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  7. ALA4797883

    Name:
    2-((4-(2-amino-4-methoxypyrimidin-5-yl)-1H-imidazo
    Show More

    Mol. Formula:
    C13H17N5O4

    M.W.:
    307.31

    Type:
    Unknown

    AlogP:
    0.47

    Polar Surface Area:
    114.38

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  8. ALA4460577

    Name:
    Tatanan A

    Mol. Formula:
    C36H48O9

    M.W.:
    624.77

    Type:
    Unknown

    AlogP:
    7.78

    Polar Surface Area:
    83.07

    HBA:
    9

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  9. ALA4550739

    Name:
    Scequinadoline A

    Mol. Formula:
    C27H31N5O3

    M.W.:
    473.58

    Type:
    Unknown

    AlogP:
    2.57

    Polar Surface Area:
    99.49

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  10. ALA5205622

    Name:
    (5-((3-azidopropyl)thio)-4,4',5'-trichloro-1'H-[1,
    Show More

    Mol. Formula:
    C27H16Cl3F6N5O4S

    M.W.:
    726.87

    Type:
    ---

    AlogP:
    9.47

    Polar Surface Area:
    144.08

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  11. ALA5204382

    Name:
    3-((6-bromoquinolin-4-yl)amino)phenol

    Mol. Formula:
    C15H11BrN2O

    M.W.:
    315.17

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    45.15

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  12. ALA5203636

    Name:
    6-((6-bromoquinolin-4-yl)amino)-1H-isoindol-1-one

    Mol. Formula:
    C17H10BrN3O

    M.W.:
    352.19

    Type:
    ---

    AlogP:
    4.31

    Polar Surface Area:
    54.35

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  13. ALA5203225

    Name:
    (4,4',5'-trichloro-5-((pyrimidin-2-ylmethyl)thio)-
    Show More

    Mol. Formula:
    C29H15Cl3F6N4O4S

    M.W.:
    735.88

    Type:
    ---

    AlogP:
    8.76

    Polar Surface Area:
    121.10

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  14. ALA5202001

    Name:
    2-((3,4',5'-trichloro-2',5-bis(2-hydroxy-4-(triflu
    Show More

    Mol. Formula:
    C29H14Cl3F6N3O5S

    M.W.:
    736.86

    Type:
    ---

    AlogP:
    8.46

    Polar Surface Area:
    122.26

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  15. ALA5201783

    Name:
    (4,4',5'-trichloro-5-((2-hydroxyethyl)thio)-1'H-[1
    Show More

    Mol. Formula:
    C26H15Cl3F6N2O5S

    M.W.:
    687.83

    Type:
    ---

    AlogP:
    7.76

    Polar Surface Area:
    115.55

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  16. ALA5201294

    Name:
    (5-((1H-imidazole-2-yl)thio)-4,4',5'-trichloro-1'H
    Show More

    Mol. Formula:
    C27H13Cl3F6N4O4S

    M.W.:
    709.84

    Type:
    ---

    AlogP:
    8.55

    Polar Surface Area:
    124.00

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  17. ALA5199401

    Name:
    (5-(benzo[d]thiazol-2-ylthio)-4,4',5'-trichloro-1'
    Show More

    Mol. Formula:
    C31H14Cl3F6N3O4S2

    M.W.:
    776.95

    Type:
    ---

    AlogP:
    10.44

    Polar Surface Area:
    108.21

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  18. ALA5197837

    Name:
    (4,4',5'-trichloro-5-((1-methyl-1H-tetrazol-5-yl)t
    Show More

    Mol. Formula:
    C26H13Cl3F6N6O4S

    M.W.:
    725.84

    Type:
    ---

    AlogP:
    7.35

    Polar Surface Area:
    138.92

    HBA:
    10

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  19. ALA5195868

    Name:
    (5-(benzo[d]oxazol-2-ylthio)-4,4',5'-trichloro-1'H
    Show More

    Mol. Formula:
    C31H14Cl3F6N3O5S

    M.W.:
    760.88

    Type:
    ---

    AlogP:
    9.97

    Polar Surface Area:
    121.35

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  20. ALA5195111

    Name:
    N4-([1,1'-biphenyl]-4-yl)-N2-(2-(2,2,6,6-tetrameth
    Show More

    Mol. Formula:
    C27H35N5

    M.W.:
    429.61

    Type:
    ---

    AlogP:
    6.25

    Polar Surface Area:
    61.87

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
Page
per page