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  1. ALA4483049

    Name:
    (1R,2S)-2-cyclohexyl-1-(4-(methylsulfonyl)phenyl)-
    Show More

    Cas Number:
    866484-00-6

    Mol. Formula:
    C20H24N2O3S2

    M.W.:
    404.56

    Type:
    Unknown

    AlogP:
    4.02

    Polar Surface Area:
    76.13

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  2. ALA4538137

    Name:
    1-(4-(3-Chloro-2-fluorophenoxy)pyridin-2-yl)-3-met
    Show More

    Mol. Formula:
    C13H11ClFN3O2

    M.W.:
    295.70

    Type:
    Unknown

    AlogP:
    3.42

    Polar Surface Area:
    63.25

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  3. ALA4522750

    Name:
    rac-6-[[(1R,1aR,6aR)-1a-Methyl-6,6a-dihydro-1H-cyc
    Show More

    Mol. Formula:
    C18H16N2O3

    M.W.:
    308.34

    Type:
    Unknown

    AlogP:
    2.48

    Polar Surface Area:
    79.29

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.91

    DETAILS
  4. ALA4522622

    Name:
    1-(5-(2-Ethoxyethyl)-4-((5-methylpyridin-3-yl)oxy)
    Show More

    Mol. Formula:
    C17H22N4O3

    M.W.:
    330.39

    Type:
    Unknown

    AlogP:
    2.91

    Polar Surface Area:
    85.37

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  5. ALA4534484

    Name:
    3-(6-(3,5-diisopropoxybenzamido)pyridin-3-yl)acryl
    Show More

    Mol. Formula:
    C21H24N2O5

    M.W.:
    384.43

    Type:
    Unknown

    AlogP:
    4.01

    Polar Surface Area:
    97.75

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  6. ALA4533000

    Name:
    (S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
    Show More

    Mol. Formula:
    C18H22N4O4

    M.W.:
    358.40

    Type:
    Unknown

    AlogP:
    2.92

    Polar Surface Area:
    94.60

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  7. ALA4531223

    Name:
    (S)-1-(6'-(2-Hydroxypropoxy)-4-((5-methylpyridin-3
    Show More

    Mol. Formula:
    C21H23N5O4

    M.W.:
    409.45

    Type:
    Unknown

    AlogP:
    3.15

    Polar Surface Area:
    118.49

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  8. ALA4554222

    Name:
    1-(5-((1S,3S)-3-Hydroxycyclohexyl)-4-((5-methylpyr
    Show More

    Mol. Formula:
    C19H24N4O3

    M.W.:
    356.43

    Type:
    Unknown

    AlogP:
    3.35

    Polar Surface Area:
    96.37

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  9. ALA4553907

    Name:
    (R)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
    Show More

    Mol. Formula:
    C18H22N4O4

    M.W.:
    358.40

    Type:
    Unknown

    AlogP:
    2.92

    Polar Surface Area:
    94.60

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  10. ALA4551474

    Name:
    1-(4-(2,6-Difluorophenoxy)-[3,4'-bipyridin]-6-yl)-
    Show More

    Mol. Formula:
    C18H14F2N4O2

    M.W.:
    356.33

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    76.14

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  11. ALA4566968

    Name:
    1-(6'-(2-Hydroxyethoxy)-4-((4-methylpyridin-3-yl)o
    Show More

    Mol. Formula:
    C20H21N5O4

    M.W.:
    395.42

    Type:
    Unknown

    AlogP:
    2.76

    Polar Surface Area:
    118.49

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  12. ALA4529989

    Name:
    1-(5-((cis)-3-(Hydroxymethyl)cyclobutyl)-4-((5-met
    Show More

    Mol. Formula:
    C18H22N4O3

    M.W.:
    342.40

    Type:
    Unknown

    AlogP:
    2.81

    Polar Surface Area:
    96.37

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  13. ALA4529355

    Name:
    1-(5-(4-Hydroxybutyl)-4-((5-methylpyridin-3-yl)oxy
    Show More

    Mol. Formula:
    C17H22N4O3

    M.W.:
    330.39

    Type:
    Unknown

    AlogP:
    2.64

    Polar Surface Area:
    96.37

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  14. ALA4529100

    Name:
    1-(5-((trans)-1,3-Dihydroxycyclobutyl)-4-((5-methy
    Show More

    Mol. Formula:
    C17H20N4O4

    M.W.:
    344.37

    Type:
    Unknown

    AlogP:
    1.67

    Polar Surface Area:
    116.60

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  15. ALA4528539

    Name:
    1-(4-(2,6-Difluorophenoxy)-6'-ethoxy-[3,3'-bipyrid
    Show More

    Mol. Formula:
    C20H18F2N4O3

    M.W.:
    400.39

    Type:
    Unknown

    AlogP:
    4.36

    Polar Surface Area:
    85.37

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  16. ALA4528120

    Name:
    1-(4-(2,6-Difluorophenoxy)-6'-(2-hydroxyethoxy)-[3
    Show More

    Mol. Formula:
    C20H18F2N4O4

    M.W.:
    416.38

    Type:
    Unknown

    AlogP:
    3.34

    Polar Surface Area:
    105.60

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  17. ALA4527697

    Name:
    (S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(1-methylp
    Show More

    Mol. Formula:
    C19H25N5O3

    M.W.:
    371.44

    Type:
    Unknown

    AlogP:
    2.84

    Polar Surface Area:
    88.61

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  18. ALA4518905

    Name:
    1-(4-(2,6-Difluorophenoxy)-6'-methoxy-[3,3'-bipyri
    Show More

    Mol. Formula:
    C19H16F2N4O3

    M.W.:
    386.36

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    85.37

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  19. ALA4516141

    Name:
    1-(5-(3-Hydroxypropyl)-4-((5-methylpyridin-3-yl)ox
    Show More

    Mol. Formula:
    C16H20N4O3

    M.W.:
    316.36

    Type:
    Unknown

    AlogP:
    2.25

    Polar Surface Area:
    96.37

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  20. ALA4515481

    Name:
    (S)-1-(4-((5-Methoxypyridin-3-yl)oxy)-5-(tetrahydr
    Show More

    Mol. Formula:
    C17H20N4O4

    M.W.:
    344.37

    Type:
    Unknown

    AlogP:
    2.53

    Polar Surface Area:
    94.60

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
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