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  1. ALA1080794

    Name:
    4-butyl-3-(cyclohexylmethyl)-8-(1-(2,6-dimethylben
    Show More

    Mol. Formula:
    C32H49N3O3

    M.W.:
    523.76

    Type:
    Small molecule

    AlogP:
    6.33

    Polar Surface Area:
    53.09

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  2. ALA1078335

    Name:
    (5S)-5-butyl-9-(1-(2,4-dimethylnicotinoyl)-4-methy
    Show More

    Mol. Formula:
    C32H50N4O4

    M.W.:
    554.78

    Type:
    Small molecule

    AlogP:
    5.36

    Polar Surface Area:
    75.21

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  3. ALA1078714

    Name:
    (5S)-5-butyl-3-((4,4-difluorocyclohexyl)methyl)-9-
    Show More

    Mol. Formula:
    C32H49F2N5O3

    M.W.:
    589.77

    Type:
    Small molecule

    AlogP:
    6.01

    Polar Surface Area:
    78.87

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  4. ALA1078713

    Name:
    (S)-5-butyl-9-(1-(4,6-dimethyl-2-(trifluoromethyl)
    Show More

    Mol. Formula:
    C32H48F3N5O4

    M.W.:
    623.76

    Type:
    Small molecule

    AlogP:
    5.63

    Polar Surface Area:
    88.10

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  5. ALA1078712

    Name:
    (S)-5-butyl-9-(1-(4,6-dimethyl-2-oxo-2H-pyran-5-ca
    Show More

    Mol. Formula:
    C32H49N3O6

    M.W.:
    571.76

    Type:
    Small molecule

    AlogP:
    4.77

    Polar Surface Area:
    92.53

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  6. ALA1078937

    Name:
    (S)-5-(4-(5-butyl-3-methyl-2-oxo-1-oxa-3,9-diazasp
    Show More

    Mol. Formula:
    C28H41N5O3

    M.W.:
    495.67

    Type:
    Small molecule

    AlogP:
    4.29

    Polar Surface Area:
    89.77

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  7. ALA1078711

    Name:
    (+/-)-5-(4-(5-butyl-2-oxo-3-((tetrahydro-2H-pyran-
    Show More

    Mol. Formula:
    C33H49N5O4

    M.W.:
    579.79

    Type:
    Small molecule

    AlogP:
    5.08

    Polar Surface Area:
    99.00

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  8. ALA1078710

    Name:
    (S)-3-(4-(5-butyl-2-oxo-3-((tetrahydro-2H-pyran-4-
    Show More

    Mol. Formula:
    C32H50N4O5

    M.W.:
    570.78

    Type:
    Small molecule

    AlogP:
    4.45

    Polar Surface Area:
    89.26

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  9. ALA1078936

    Name:
    (S)-5-butyl-9-(1-(2,4-dimethylnicotinoyl)-4-methyl
    Show More

    Mol. Formula:
    C32H50N4O4

    M.W.:
    554.78

    Type:
    Small molecule

    AlogP:
    5.21

    Polar Surface Area:
    75.21

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  10. ALA1078141

    Name:
    (R)-5-butyl-9-(1-(4,6-dimethylpyrimidine-5-carbony
    Show More

    Mol. Formula:
    C31H49N5O4

    M.W.:
    555.76

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    88.10

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  11. ALA1078723

    Name:
    5-butyl-9-(1-(4,6-dimethylpyrimidine-5-carbonyl)-4
    Show More

    Mol. Formula:
    C31H49N5O4

    M.W.:
    555.76

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    88.10

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  12. ALA1078015

    Name:
    5-butyl-9-(1-(4,6-dimethylpyrimidine-5-carbonyl)pi
    Show More

    Mol. Formula:
    C30H47N5O4

    M.W.:
    541.74

    Type:
    Small molecule

    AlogP:
    4.22

    Polar Surface Area:
    88.10

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  13. ALA1078014

    Name:
    5-butyl-9-(1-(2,6-dimethylbenzoyl)piperidin-4-yl)-
    Show More

    Mol. Formula:
    C32H49N3O4

    M.W.:
    539.76

    Type:
    Small molecule

    AlogP:
    5.43

    Polar Surface Area:
    62.32

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  14. ALA1078013

    Name:
    5-butyl-3-(cyclohexylmethyl)-9-(1-(4,6-dimethylpyr
    Show More

    Mol. Formula:
    C31H49N5O3

    M.W.:
    539.77

    Type:
    Small molecule

    AlogP:
    5.37

    Polar Surface Area:
    78.87

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  15. ALA1078753

    Name:
    5-butyl-3-(cyclohexylmethyl)-9-(1-(2,6-dimethylben
    Show More

    Mol. Formula:
    C33H51N3O3

    M.W.:
    537.79

    Type:
    Small molecule

    AlogP:
    6.58

    Polar Surface Area:
    53.09

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  16. ALA1078659

    Name:
    4-butyl-8-(1-(4,6-dimethylpyrimidine-5-carbonyl)-4
    Show More

    Mol. Formula:
    C30H47N5O4

    M.W.:
    541.74

    Type:
    Small molecule

    AlogP:
    4.36

    Polar Surface Area:
    88.10

    HBA:
    7

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  17. ALA1077912

    Name:
    4-butyl-3-(cyclohexylmethyl)-8-(1-(4,6-dimethylpyr
    Show More

    Mol. Formula:
    C31H49N5O3

    M.W.:
    539.77

    Type:
    Small molecule

    AlogP:
    5.51

    Polar Surface Area:
    78.87

    HBA:
    6

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  18. ALA1077779

    Name:
    4-butyl-3-(cyclohexylmethyl)-8-(1-(2,6-dimethylben
    Show More

    Mol. Formula:
    C33H51N3O3

    M.W.:
    537.79

    Type:
    Small molecule

    AlogP:
    6.72

    Polar Surface Area:
    53.09

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  19. ALA1078648

    Name:
    3-(cyclohexylmethyl)-8-(1-(2,6-dimethylbenzoyl)pip
    Show More

    Mol. Formula:
    C31H47N3O3

    M.W.:
    509.74

    Type:
    Small molecule

    AlogP:
    5.94

    Polar Surface Area:
    53.09

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  20. ALA1078647

    Name:
    3-benzyl-4-butyl-8-(1-(2,6-dimethylbenzoyl)piperid
    Show More

    Mol. Formula:
    C32H43N3O3

    M.W.:
    517.71

    Type:
    Small molecule

    AlogP:
    5.95

    Polar Surface Area:
    53.09

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
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