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

Items 1-20 of 916

Set Ascending Direction
Select all
  1. ALA4869813

    Name:
    (S)-((S)-3-bromo-4,5-dihydroisoxazol-5-yl)(3-pheny
    Show More

    Mol. Formula:
    C12H11BrN4O2

    M.W.:
    323.15

    Type:
    Unknown

    AlogP:
    2.23

    Polar Surface Area:
    86.53

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.94

    DETAILS
  2. ALA4869210

    Name:
    1'-(3-ethoxy-4-hydroxybenzylideneamino)-5'-oxo-1',
    Show More

    Mol. Formula:
    C26H20N4O3

    M.W.:
    436.47

    Type:
    Unknown

    AlogP:
    4.42

    Polar Surface Area:
    97.95

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  3. ALA5285910

    Name:
    2-(3-Methoxy-5-nitro-1H-indazol-1-yl)ethan-1-amine

    Mol. Formula:
    C10H12N4O3

    M.W.:
    236.23

    Type:
    ---

    AlogP:
    0.91

    Polar Surface Area:
    96.21

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  4. ALA4866720

    Name:
    1'-(4-chlorobenzylideneamino)-5'-oxo-1',5'-dihydro
    Show More

    Mol. Formula:
    C24H15ClN4O

    M.W.:
    410.86

    Type:
    Unknown

    AlogP:
    4.97

    Polar Surface Area:
    68.49

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  5. ALA4866158

    Name:
    1'-(4-(dimethylamino)benzylideneamino)-5'-oxo-1',5
    Show More

    Mol. Formula:
    C26H21N5O

    M.W.:
    419.49

    Type:
    Unknown

    AlogP:
    4.38

    Polar Surface Area:
    71.73

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  6. ALA4864938

    Name:
    1'-(2,4-dichlorobenzylideneamino)-5'-oxo-1',5'-dih
    Show More

    Mol. Formula:
    C24H14Cl2N4O

    M.W.:
    445.31

    Type:
    Unknown

    AlogP:
    5.62

    Polar Surface Area:
    68.49

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  7. ALA4864557

    Name:
    Edelfosine

    Mol. Formula:
    C28H60NO6P

    M.W.:
    537.76

    Type:
    Unknown

    AlogP:
    6.88

    Polar Surface Area:
    77.05

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    28

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  8. ALA4859736

    Name:
    1'-(2,6-dichlorobenzylideneamino)-5'-oxo-1',5'-dih
    Show More

    Mol. Formula:
    C24H14Cl2N4O

    M.W.:
    445.31

    Type:
    Unknown

    AlogP:
    5.62

    Polar Surface Area:
    68.49

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  9. ALA4859138

    Name:
    1'-(4-nitrobenzylideneamino)-5'-oxo-1',5'-dihydro-
    Show More

    Mol. Formula:
    C24H15N5O3

    M.W.:
    421.42

    Type:
    Unknown

    AlogP:
    4.22

    Polar Surface Area:
    111.63

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  10. ALA4858135

    Name:
    1'-(benzylideneamino)-5'-oxo-1',5'-dihydro-10H-spi
    Show More

    Mol. Formula:
    C24H16N4O

    M.W.:
    376.42

    Type:
    Unknown

    AlogP:
    4.31

    Polar Surface Area:
    68.49

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  11. ALA4857885

    Name:
    1'-(4-fluorobenzylideneamino)-5'-oxo-1',5'-dihydro
    Show More

    Mol. Formula:
    C24H15FN4O

    M.W.:
    394.41

    Type:
    Unknown

    AlogP:
    4.45

    Polar Surface Area:
    68.49

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  12. ALA4790606

    Name:
    Buchtienine

    Mol. Formula:
    C31H34N4O2

    M.W.:
    494.64

    Type:
    Unknown

    AlogP:
    5.19

    Polar Surface Area:
    73.15

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  13. ALA4790084

    Name:
    N-(3-(Trifluoromethyl)phenyl)-2-(3,4-dihydro-1-phe
    Show More

    Mol. Formula:
    C26H22F3N3O

    M.W.:
    449.48

    Type:
    Unknown

    AlogP:
    5.77

    Polar Surface Area:
    48.13

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  14. ALA4862013

    Name:
    1'-(2-nitrobenzylideneamino)-5'-oxo-1',5'-dihydro-
    Show More

    Mol. Formula:
    C24H15N5O3

    M.W.:
    421.42

    Type:
    Unknown

    AlogP:
    4.22

    Polar Surface Area:
    111.63

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  15. ALA4868264

    Name:
    5-(3-bromo-4,5-dihydroisoxazol-5-yl)-3-(4-fluoroph
    Show More

    Mol. Formula:
    C11H7BrFN3O2

    M.W.:
    312.10

    Type:
    Unknown

    AlogP:
    3.05

    Polar Surface Area:
    60.51

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  16. ALA4776364

    Name:
    2-(3,4-Dihydro-1-phenyl-1H-pyrido[3,4-b]indol-2(9H
    Show More

    Mol. Formula:
    C29H25N3O

    M.W.:
    431.54

    Type:
    Unknown

    AlogP:
    5.91

    Polar Surface Area:
    48.13

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  17. ALA4556142

    Name:
    Diphenyl(2-(naphthalen-2-yl)-4-phenyl quinolin-8-y
    Show More

    Mol. Formula:
    C37H26NOP

    M.W.:
    531.60

    Type:
    Unknown

    AlogP:
    8.36

    Polar Surface Area:
    29.96

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  18. ALA4555847

    Name:
    6-chloro-8-(4-chlorophenylthio)-2-(phenylsulfonylm
    Show More

    Mol. Formula:
    C20H15Cl2N3O2S2

    M.W.:
    464.40

    Type:
    Unknown

    AlogP:
    5.35

    Polar Surface Area:
    77.46

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  19. ALA5273909

    Name:
    4-amino-2-((4-amino-5-mercapto-4H-1,2,4-triazol-3-
    Show More

    Mol. Formula:
    C10H12N8OS2

    M.W.:
    324.40

    Type:
    ---

    AlogP:
    -0.95

    Polar Surface Area:
    122.57

    HBA:
    11

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  20. ALA5272987

    Name:
    6,7-dimethoxy-4-(selenocyanatomethyl)-2H-chromen-2
    Show More

    Mol. Formula:
    C13H11NO4Se

    M.W.:
    324.19

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
Page
per page