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

Items 1-20 of 368

Set Ascending Direction
Select all
  1. SJB2-043

    Name:
    2-phenylnaphtho[2,3-d]oxazole-4,9-dione

    Mol. Formula:
    C17H9NO3

    M.W.:
    275.26

    Type:
    Small molecule

    AlogP:
    3.12

    Polar Surface Area:
    60.17

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  2. C527

    Name:
    2-(4-fluorophenyl)naphtho[2,3-d]oxazole-4,9-dione

    Mol. Formula:
    C17H8FNO3

    M.W.:
    293.25

    Type:
    Small molecule

    AlogP:
    3.26

    Polar Surface Area:
    60.17

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  3. ALA3392896

    Name:
    SID144116932

    Mol. Formula:
    C27H28N4O2S

    M.W.:
    472.61

    Type:
    Small molecule

    AlogP:
    5.50

    Polar Surface Area:
    97.97

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  4. ALA3392825

    Name:
    SID144116878

    Mol. Formula:
    C29H24F3N5O2S

    M.W.:
    563.61

    Type:
    Small molecule

    AlogP:
    6.24

    Polar Surface Area:
    88.08

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  5. ALA3392773

    Name:
    SID144116880

    Mol. Formula:
    C26H17F3N4O2S

    M.W.:
    506.51

    Type:
    Small molecule

    AlogP:
    6.18

    Polar Surface Area:
    84.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  6. ALA3392716

    Name:
    SID144116876

    Mol. Formula:
    C21H13BrF3N3O2S

    M.W.:
    508.32

    Type:
    Small molecule

    AlogP:
    5.88

    Polar Surface Area:
    71.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  7. ALA3392698

    Name:
    SID144116919

    Mol. Formula:
    C28H22F3N5O2S

    M.W.:
    549.58

    Type:
    Small molecule

    AlogP:
    6.36

    Polar Surface Area:
    96.87

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  8. ALA3392691

    Name:
    SID144116879

    Mol. Formula:
    C27H16F6N4O2S

    M.W.:
    574.51

    Type:
    Small molecule

    AlogP:
    7.20

    Polar Surface Area:
    84.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  9. ALA3189125

    Name:
    SID24391476

    Mol. Formula:
    C19H16ClFN6

    M.W.:
    382.83

    Type:
    Small molecule

    AlogP:
    3.98

    Polar Surface Area:
    68.52

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  10. ALA3189120

    Name:
    SID144116941

    Mol. Formula:
    C26H26N4S

    M.W.:
    426.59

    Type:
    Small molecule

    AlogP:
    6.66

    Polar Surface Area:
    50.70

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  11. ALA3189108

    Name:
    SID24787795

    Mol. Formula:
    C15H23BrN2O4S

    M.W.:
    407.33

    Type:
    Small molecule

    AlogP:
    1.77

    Polar Surface Area:
    67.87

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  12. ALA3189098

    Name:
    SID144116963

    Mol. Formula:
    C23H27N5O

    M.W.:
    389.50

    Type:
    Small molecule

    AlogP:
    3.67

    Polar Surface Area:
    74.17

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  13. ALA3189092

    Name:
    SID144116971

    Mol. Formula:
    C21H18F2N6

    M.W.:
    392.41

    Type:
    Small molecule

    AlogP:
    4.58

    Polar Surface Area:
    68.52

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  14. ALA3189068

    Name:
    SID89854114

    Mol. Formula:
    C7H9N5O2S2

    M.W.:
    259.32

    Type:
    Small molecule

    AlogP:
    -0.05

    Polar Surface Area:
    101.54

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  15. ALA3189009

    Name:
    SID144116986

    Mol. Formula:
    C26H25FN4

    M.W.:
    412.51

    Type:
    Small molecule

    AlogP:
    6.39

    Polar Surface Area:
    50.70

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  16. ALA3189000

    Name:
    SID24413444

    Mol. Formula:
    C19H16F3N3O4

    M.W.:
    407.35

    Type:
    Small molecule

    AlogP:
    2.64

    Polar Surface Area:
    78.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  17. ALA3188978

    Name:
    SID24407360

    Mol. Formula:
    C19H26N4O5S

    M.W.:
    422.51

    Type:
    Small molecule

    AlogP:
    1.24

    Polar Surface Area:
    100.95

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  18. ALA3188963

    Name:
    SID144116911

    Mol. Formula:
    C28H20F3N3

    M.W.:
    455.48

    Type:
    Small molecule

    AlogP:
    7.59

    Polar Surface Area:
    37.81

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  19. ALA3188953

    Name:
    SID144116900

    Mol. Formula:
    C26H19BrN4

    M.W.:
    467.37

    Type:
    Small molecule

    AlogP:
    6.73

    Polar Surface Area:
    50.70

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  20. ALA3188937

    Name:
    SID144116858

    Mol. Formula:
    C29H22F3N3

    M.W.:
    469.51

    Type:
    Small molecule

    AlogP:
    8.16

    Polar Surface Area:
    37.81

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
Page
per page