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  1. ALA5270782

    Name:
    Plagiochiline I

    Mol. Formula:
    C17H24O5

    M.W.:
    308.37

    Type:
    ---

    AlogP:
    1.85

    Polar Surface Area:
    68.29

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  2. ALA5268659

    Name:
    (3aR,4R,5S,5aR,10bR)-3a-hydroxy-N,8,10-trimethoxy-5a-(4-methoxyphenyl)-N,2-Show More

    Mol. Formula:
    C31H33N3O7

    M.W.:
    559.62

    Type:
    ---

    AlogP:
    3.34

    Polar Surface Area:
    111.08

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  3. ALA5280849

    Name:
    2-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-(4-fluorophenyl)hydrazine-1-carShow More

    Mol. Formula:
    C14H9F4N5O4S

    M.W.:
    419.32

    Type:
    ---

    AlogP:
    3.97

    Polar Surface Area:
    122.37

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  4. ALA5209223

    Name:
    2-(3-Fluorophenyl)-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)acetamide

    Mol. Formula:
    C19H15FN2O2

    M.W.:
    322.34

    Type:
    ---

    AlogP:
    3.16

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  5. ALA5208915

    Name:
    N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)-2-(o-tolyl)acetamide

    Mol. Formula:
    C20H18N2O2

    M.W.:
    318.38

    Type:
    ---

    AlogP:
    3.33

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  6. ALA5207973

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-{3-methyl-4-[4-(4-methylpipShow More

    Mol. Formula:
    C30H38F2N6O3

    M.W.:
    568.67

    Type:
    ---

    AlogP:
    4.62

    Polar Surface Area:
    75.22

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  7. ALA5206671

    Name:
    2-(2-Chlorophenyl)-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)acetamide

    Mol. Formula:
    C19H15ClN2O2

    M.W.:
    338.79

    Type:
    ---

    AlogP:
    3.67

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  8. ALA5206147

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-{3-fluoro-4-[4-(4-methylpipShow More

    Mol. Formula:
    C29H35F3N6O3

    M.W.:
    572.63

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    75.22

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  9. ALA5204767

    Name:
    2-(3-Bromophenyl)-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)acetamide

    Mol. Formula:
    C19H15BrN2O2

    M.W.:
    383.25

    Type:
    ---

    AlogP:
    3.78

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  10. ALA5203110

    Name:
    N-(6-Oxo-1-phenyl-1,6-dihydropyridin-3-yl)-2-(2,4,6-trifluorophenyl)acetamiShow More

    Mol. Formula:
    C19H13F3N2O2

    M.W.:
    358.32

    Type:
    ---

    AlogP:
    3.44

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  11. ALA5201061

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-{1-[2-(piperazin-1-yl)ethylShow More

    Mol. Formula:
    C22H30Cl3F2N7O3

    M.W.:
    584.88

    Type:
    ---

    AlogP:
    2.20

    Polar Surface Area:
    98.59

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  12. ALA5200755

    Name:
    N-(6-Oxo-1-phenyl-1,6-dihydropyridin-3-yl)-2-(p-tolyl)-acetamide

    Mol. Formula:
    C20H18N2O2

    M.W.:
    318.38

    Type:
    ---

    AlogP:
    3.33

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  13. ALA5200481

    Name:
    2-Cyclohexyl-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)-acetamide

    Mol. Formula:
    C19H22N2O2

    M.W.:
    310.40

    Type:
    ---

    AlogP:
    3.75

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  14. ALA5197909

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-(1-{2-[(1-methylpiperidin-4Show More

    Mol. Formula:
    C24H34Cl3F2N7O3

    M.W.:
    612.94

    Type:
    ---

    AlogP:
    2.97

    Polar Surface Area:
    98.59

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  15. ALA5197399

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-{5-methoxy-6-[4-(4-methylpiShow More

    Mol. Formula:
    C29H37F2N7O4

    M.W.:
    585.66

    Type:
    ---

    AlogP:
    3.71

    Polar Surface Area:
    97.34

    HBA:
    11

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  16. ALA5195170

    Name:
    2-(2-bromophenyl)-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)acetamide

    Mol. Formula:
    C19H15BrN2O2

    M.W.:
    383.25

    Type:
    ---

    AlogP:
    3.78

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  17. ALA5194555

    Name:
    5-[2-(2,6-Difluoro-3,5-dimethoxyphenyl)ethyl]-N-{3-methoxy-4-[4-(1-methylpiShow More

    Mol. Formula:
    C31H40F2N6O3

    M.W.:
    582.70

    Type:
    ---

    AlogP:
    4.53

    Polar Surface Area:
    75.22

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  18. ALA5194091

    Name:
    2-(4-Chlorophenyl)-N-(6-oxo-1-phenyl-1,6-dihydropyridin-3-yl)acetamide

    Mol. Formula:
    C19H15ClN2O2

    M.W.:
    338.79

    Type:
    ---

    AlogP:
    3.67

    Polar Surface Area:
    51.10

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  19. ALA5193271

    Name:
    5-[2-(2,6-Difluoro-3,5-dimethoxyphenyl)ethyl]-N-[3-methoxy-4-(4-methylpiperShow More

    Mol. Formula:
    C26H31F2N5O3

    M.W.:
    499.56

    Type:
    ---

    AlogP:
    4.06

    Polar Surface Area:
    71.98

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  20. ALA5191170

    Name:
    5-[(2,6-Difluoro-3,5-dimethoxyphenyl)methoxy]-N-{6-[4-(4-methylpiperazin-1-Show More

    Mol. Formula:
    C28H35F2N7O3

    M.W.:
    555.63

    Type:
    ---

    AlogP:
    3.71

    Polar Surface Area:
    88.11

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
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