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  1. ALA4476663

    Name:
    1H-imidazo[4,5-b]pyridine

    Cas Number:
    273-21-2

    Mol. Formula:
    C6H5N3

    M.W.:
    119.13

    Type:
    Unknown

    AlogP:
    0.96

    Polar Surface Area:
    41.57

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.56

    DETAILS
  2. ALA4476519

    Name:
    N4-methyl-6-phenoxypyrimidine-2,4-diamine

    Mol. Formula:
    C11H12N4O

    M.W.:
    216.24

    Type:
    Unknown

    AlogP:
    1.89

    Polar Surface Area:
    73.06

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  3. ALA4475123

    Name:
    5-(2,3-Dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyrid
    Show More

    Mol. Formula:
    C12H9Cl2N5

    M.W.:
    294.15

    Type:
    Unknown

    AlogP:
    2.87

    Polar Surface Area:
    82.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  4. ALA4540488

    Name:
    N-(4-(2,3-dichlorophenyl)-6-(methylamino)pyrimidin
    Show More

    Mol. Formula:
    C13H12Cl2N4O

    M.W.:
    311.17

    Type:
    Unknown

    AlogP:
    3.45

    Polar Surface Area:
    66.91

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  5. ALA4537820

    Name:
    (S)-N4-methyl-6-(1-phenylethoxy)pyrimidine-2,4-dia
    Show More

    Mol. Formula:
    C13H16N4O

    M.W.:
    244.30

    Type:
    Unknown

    AlogP:
    2.24

    Polar Surface Area:
    73.06

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  6. ALA4534555

    Name:
    6-(3,4-dihydroisoquinolin-2(1H)-yl)-N4-methylpyrim
    Show More

    Mol. Formula:
    C14H17N5

    M.W.:
    255.32

    Type:
    Unknown

    AlogP:
    1.66

    Polar Surface Area:
    67.07

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  7. ALA4532517

    Name:
    N4,N4,N6-trimethylpyrimidine-2,4,6-triamine

    Mol. Formula:
    C7H13N5

    M.W.:
    167.22

    Type:
    Unknown

    AlogP:
    0.17

    Polar Surface Area:
    67.07

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  8. ALA4531128

    Name:
    7-Methyl-5-(piperidin-1-yl)-[1,2,4]triazolo[1,5-a]
    Show More

    Mol. Formula:
    C12H17N5

    M.W.:
    231.30

    Type:
    Unknown

    AlogP:
    1.61

    Polar Surface Area:
    59.45

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  9. ALA4561244

    Name:
    7-(3-fluoropyridin-4-yl)-3H-imidazo[4,5-b]pyridin-
    Show More

    Mol. Formula:
    C11H8FN5

    M.W.:
    229.22

    Type:
    Unknown

    AlogP:
    1.74

    Polar Surface Area:
    80.48

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  10. ALA4570428

    Name:
    5-(2,3-dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyrid
    Show More

    Mol. Formula:
    C12H8Cl2N4

    M.W.:
    279.13

    Type:
    Unknown

    AlogP:
    3.29

    Polar Surface Area:
    56.21

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  11. ALA4570266

    Name:
    N-(5-(2,3-dimethylphenyl)-1,2,3,4-tetrahydro-1,6-n
    Show More

    Mol. Formula:
    C20H23N3O

    M.W.:
    321.42

    Type:
    Unknown

    AlogP:
    4.07

    Polar Surface Area:
    54.02

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  12. ALA4568781

    Name:
    4-(2,3-Dichlorophenyl)-6-methyl-1H-benzo[d]imidazo
    Show More

    Mol. Formula:
    C14H11Cl2N3

    M.W.:
    292.17

    Type:
    Unknown

    AlogP:
    4.43

    Polar Surface Area:
    54.70

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  13. ALA4529335

    Name:
    N-[5-(2,3-dimethylphenyl)-1,2,3,4-tetrahydro-1,6-n
    Show More

    Mol. Formula:
    C19H23N3O

    M.W.:
    309.41

    Type:
    Unknown

    AlogP:
    4.07

    Polar Surface Area:
    54.02

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  14. ALA4517777

    Name:
    6-(2,3-dimethylphenyl)-N4-methylpyridine-2,4-diami
    Show More

    Mol. Formula:
    C14H17N3

    M.W.:
    227.31

    Type:
    Unknown

    AlogP:
    2.99

    Polar Surface Area:
    50.94

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    Y

    QED Weighted:
    0.83

    DETAILS
  15. ALA4547418

    Name:
    4-((4-(1H-pyrrolo[2,3-b]pyridin-3-yl)thiazol-2-yl)
    Show More

    Mol. Formula:
    C15H16N4OS

    M.W.:
    300.39

    Type:
    Unknown

    AlogP:
    2.52

    Polar Surface Area:
    54.04

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  16. ALA4763327

    Name:
    9-benzyl-2-(2-methoxyethoxy)-6-(methylamino)-7H-pu
    Show More

    Mol. Formula:
    C16H19N5O3

    M.W.:
    329.36

    Type:
    Unknown

    AlogP:
    1.23

    Polar Surface Area:
    94.06

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  17. ALA4577002

    Name:
    N-(5-(2,3-dimethylphenyl)-1,2,3,4-tetrahydro-1,6-n
    Show More

    Mol. Formula:
    C20H25N3O

    M.W.:
    323.44

    Type:
    Unknown

    AlogP:
    4.32

    Polar Surface Area:
    54.02

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  18. ALA4575540

    Name:
    N-(5-(2,3-dimethylphenyl)-1,2,3,4-tetrahydro-1,6-n
    Show More

    Mol. Formula:
    C17H21N3O2S

    M.W.:
    331.44

    Type:
    Unknown

    AlogP:
    3.10

    Polar Surface Area:
    71.09

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  19. ALA4574443

    Name:
    6-(2,3-Dimethylphenoxy)-N4-methylpyrimidine-2,4-di
    Show More

    Mol. Formula:
    C13H16N4O

    M.W.:
    244.30

    Type:
    Unknown

    AlogP:
    2.51

    Polar Surface Area:
    73.06

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  20. ALA4578510

    Name:
    N4-(2,3-dimethylphenyl)-N6-methylpyrimidine-2,4,6-
    Show More

    Mol. Formula:
    C13H17N5

    M.W.:
    243.31

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    75.86

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
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