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

Items 1-20 of 38

Set Ascending Direction
Select all
  1. ALA4539546

    Name:
    4-methyl-N-(pyridin-4-yl)benzamide

    Mol. Formula:
    C13H12N2O

    M.W.:
    212.25

    Type:
    Unknown

    AlogP:
    2.64

    Polar Surface Area:
    41.99

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.83

    DETAILS
  2. ALA4467852

    Name:
    4-methoxy-N-(pyridin-4-yl)benzamide

    Mol. Formula:
    C13H12N2O2

    M.W.:
    228.25

    Type:
    Unknown

    AlogP:
    2.34

    Polar Surface Area:
    51.22

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    Y

    QED Weighted:
    0.88

    DETAILS
  3. ALA4467789

    Name:
    2,4-dinitro-N-(pyridin-4-yl)benzamide

    Mol. Formula:
    C12H8N4O5

    M.W.:
    288.22

    Type:
    Unknown

    AlogP:
    2.15

    Polar Surface Area:
    128.27

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  4. ALA4455489

    Name:
    4-nitro-N-phenylbenzamide

    Mol. Formula:
    C13H10N2O3

    M.W.:
    242.23

    Type:
    Unknown

    AlogP:
    2.85

    Polar Surface Area:
    72.24

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  5. ALA4445391

    Name:
    N-(pyridin-4-yl)-3-(trifluoromethyl)benzamide

    Mol. Formula:
    C13H9F3N2O

    M.W.:
    266.22

    Type:
    Unknown

    AlogP:
    3.35

    Polar Surface Area:
    41.99

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  6. ALA4444532

    Name:
    4-nitro-N-(pyridin-4-yl)benzamide

    Mol. Formula:
    C12H9N3O3

    M.W.:
    243.22

    Type:
    Unknown

    AlogP:
    2.24

    Polar Surface Area:
    85.13

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  7. ALA4437337

    Name:
    3-chloro-N-(pyridin-4-yl)benzamide

    Mol. Formula:
    C12H9ClN2O

    M.W.:
    232.67

    Type:
    Unknown

    AlogP:
    2.99

    Polar Surface Area:
    41.99

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.87

    DETAILS
  8. 3,4,7,8-Tetramethyl-1,10-phenanthroline

    Name:
    3,4,7,8-Tetramethyl-[1,10]phenanthroline

    Mol. Formula:
    C16H16N2

    M.W.:
    236.32

    Type:
    Small molecule

    AlogP:
    4.02

    Polar Surface Area:
    25.78

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  9. ALA98573

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C24H23ClN5O5PtS+

    M.W.:
    724.08

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. 4-Methyl-1,10-phenanthroline

    Name:
    4-Methyl-[1,10]phenanthroline

    Mol. Formula:
    C13H10N2

    M.W.:
    194.24

    Type:
    Small molecule

    AlogP:
    3.09

    Polar Surface Area:
    25.78

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  11. ALA100222

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C24H23Cl2N4O3PtS+

    M.W.:
    713.52

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA419722

    Name:
    3-Benzoyl-1,1-bis-(2-diethylamino-ethyl)-thiourea

    Mol. Formula:
    C20H34N4OS

    M.W.:
    378.59

    Type:
    Small molecule

    AlogP:
    2.69

    Polar Surface Area:
    38.82

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  13. ALA316647

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C32H42ClN6OPtS+

    M.W.:
    789.33

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. 5-Nitro-1,10-phenanthroline

    Name:
    5-Nitro-[1,10]phenanthroline

    Mol. Formula:
    C12H7N3O2

    M.W.:
    225.21

    Type:
    Small molecule

    AlogP:
    2.69

    Polar Surface Area:
    68.92

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  15. ALA319607

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C22H24ClN4O3PtS+

    M.W.:
    655.06

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA100808

    Name:
    3-Benzoyl-1,1-bis-(2-hydroxy-ethyl)-thiourea

    Mol. Formula:
    C12H16N2O3S

    M.W.:
    268.34

    Type:
    Small molecule

    AlogP:
    -0.01

    Polar Surface Area:
    72.80

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  17. 4,4′-Di-tert-butyl-2,2′-dipyridyl

    Name:
    4,4'-Di-tert-butyl-[2,2']bipyridinyl

    Mol. Formula:
    C18H24N2

    M.W.:
    268.40

    Type:
    Small molecule

    AlogP:
    4.74

    Polar Surface Area:
    25.78

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  18. ALA101165

    Name:
    4,4'-Dimethyl-[2,2']bipyridinyl

    Mol. Formula:
    C12H12N2

    M.W.:
    184.24

    Type:
    Small molecule

    AlogP:
    2.76

    Polar Surface Area:
    25.78

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.68

    DETAILS
  19. ALA98789

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C24H28ClN4O3PtS+

    M.W.:
    683.11

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  20. ALA317496

    Name:
    1,10-Phenanthrolineplatinum (II) Benzoylthiourea Complex

    Mol. Formula:
    C25H26ClN4O3PtS+

    M.W.:
    693.11

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
Page
per page