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  1. ALA4548666

    Name:
    sodium (2R)-2-[(2R,5S,6R)-6-[(1S,2S,3S,5R)-5-[(3S,
    Show More

    Mol. Formula:
    C45H73NaO13

    M.W.:
    845.06

    Type:
    Unknown

    AlogP:
    7.37

    Polar Surface Area:
    176.51

    HBA:
    12

    HBD:
    3

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  2. ALA4550418

    Name:
    sodium (2R)-2-[(2R,5S,6R)-6-[(1S,2S,3S,5R)-5-[(3S,
    Show More

    Mol. Formula:
    C46H70NNaO13

    M.W.:
    868.05

    Type:
    Unknown

    AlogP:
    7.04

    Polar Surface Area:
    193.31

    HBA:
    13

    HBD:
    3

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  3. ALA4555673

    Name:
    sodium (2R)-2-[(2R,5S,6R)-6-[(1S,2S,3S,5R)-5-[(3S,
    Show More

    Mol. Formula:
    C45H74NNaO12

    M.W.:
    844.07

    Type:
    Unknown

    AlogP:
    6.94

    Polar Surface Area:
    179.31

    HBA:
    11

    HBD:
    4

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  4. ALA5094076

    Name:
    N-[2-(4-fluoro-1-piperidyl)pyrimidin-4-yl]-3-(4-me
    Show More

    Mol. Formula:
    C19H20FN5O2

    M.W.:
    369.40

    Type:
    Unknown

    AlogP:
    3.82

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  5. ALA5093854

    Name:
    N-(2-morpholinopyrimidin-4-yl)-3-[4-(trifluorometh
    Show More

    Mol. Formula:
    C18H16F3N5O2

    M.W.:
    391.35

    Type:
    Unknown

    AlogP:
    3.73

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  6. ALA5093441

    Name:
    3-(4-methoxyphenyl)-N-[2-(1-piperidyl)pyrimidin-4-
    Show More

    Mol. Formula:
    C19H21N5O2

    M.W.:
    351.41

    Type:
    Unknown

    AlogP:
    3.87

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  7. ALA5093087

    Name:
    3-(4-methoxyphenyl)-N-(2-piperazin-1-ylpyrimidin-4
    Show More

    Mol. Formula:
    C18H20N6O2

    M.W.:
    352.40

    Type:
    Unknown

    AlogP:
    2.29

    Polar Surface Area:
    88.34

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  8. ALA5092139

    Name:
    3-(4-methylsulfanylphenyl)-N-(2-morpholinopyrimidi
    Show More

    Mol. Formula:
    C18H19N5O2S

    M.W.:
    369.45

    Type:
    Unknown

    AlogP:
    3.43

    Polar Surface Area:
    76.31

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  9. ALA5091887

    Name:
    3-(3-fluoro-4-methoxy-phenyl)-N-(2-pyrrolidin-1-yl
    Show More

    Mol. Formula:
    C18H18FN5O2

    M.W.:
    355.37

    Type:
    Unknown

    AlogP:
    3.62

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  10. ALA5091598

    Name:
    3-[4-(1,1-difluoroethyl)phenyl]-N-(2-morpholinopyr
    Show More

    Mol. Formula:
    C19H19F2N5O2

    M.W.:
    387.39

    Type:
    Unknown

    AlogP:
    3.82

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  11. ALA5091564

    Name:
    3-(3-fluoro-4-methoxy-phenyl)-N-[2-(4-fluoro-1-pip
    Show More

    Mol. Formula:
    C19H19F2N5O2

    M.W.:
    387.39

    Type:
    Unknown

    AlogP:
    3.96

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  12. ALA5091372

    Name:
    N-(2-morpholinopyrimidin-4-yl)-3-(p-tolyl)isoxazol
    Show More

    Mol. Formula:
    C18H19N5O2

    M.W.:
    337.38

    Type:
    Unknown

    AlogP:
    3.02

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  13. ALA5091264

    Name:
    N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)pyrimidin-4-yl]
    Show More

    Mol. Formula:
    C18H19N5O4S

    M.W.:
    401.45

    Type:
    Unknown

    AlogP:
    2.12

    Polar Surface Area:
    110.45

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.69

    DETAILS
  14. ALA5091202

    Name:
    3-(3-methoxyphenyl)-N-(2-morpholinopyrimidin-4-yl)
    Show More

    Mol. Formula:
    C18H19N5O3

    M.W.:
    353.38

    Type:
    Unknown

    AlogP:
    2.72

    Polar Surface Area:
    85.54

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  15. ALA5091000

    Name:
    2-[4-[4-[[3-(4-methoxyphenyl)isoxazol-5-yl]amino]p
    Show More

    Mol. Formula:
    C20H24N6O3

    M.W.:
    396.45

    Type:
    Unknown

    AlogP:
    2.00

    Polar Surface Area:
    99.78

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  16. ALA5090921

    Name:
    N-(2-morpholinopyrimidin-4-yl)-3-(4-propoxyphenyl)
    Show More

    Mol. Formula:
    C20H23N5O3

    M.W.:
    381.44

    Type:
    Unknown

    AlogP:
    3.50

    Polar Surface Area:
    85.54

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  17. ALA5090307

    Name:
    N-[2-(4-fluoro-1-piperidyl)-6-methyl-pyrimidin-4-y
    Show More

    Mol. Formula:
    C20H22FN5O2

    M.W.:
    383.43

    Type:
    Unknown

    AlogP:
    4.13

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  18. ALA5089750

    Name:
    3-(4-benzyloxyphenyl)-N-(2-morpholinopyrimidin-4-y
    Show More

    Mol. Formula:
    C24H23N5O3

    M.W.:
    429.48

    Type:
    Unknown

    AlogP:
    4.29

    Polar Surface Area:
    85.54

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  19. ALA5089424

    Name:
    N-(2-((1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl
    Show More

    Mol. Formula:
    C19H19N5O3

    M.W.:
    365.39

    Type:
    Unknown

    AlogP:
    2.86

    Polar Surface Area:
    85.54

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  20. ALA5089373

    Name:
    3-(4-methoxyphenyl)-N-(2-pyrrolidin-1-ylpyrimidin-
    Show More

    Mol. Formula:
    C18H19N5O2

    M.W.:
    337.38

    Type:
    Unknown

    AlogP:
    3.48

    Polar Surface Area:
    76.31

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
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