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  1. ALA4878267

    Name:
    4-(furan-2-yl)-N-hexyl-6-(trifluoromethyl)pyrimidi
    Show More

    Mol. Formula:
    C15H18F3N3O

    M.W.:
    313.32

    Type:
    Unknown

    AlogP:
    4.75

    Polar Surface Area:
    50.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  2. ALA4878029

    Name:
    3-(((4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2
    Show More

    Mol. Formula:
    C16H12F3N3O2

    M.W.:
    335.29

    Type:
    Unknown

    AlogP:
    4.07

    Polar Surface Area:
    71.18

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  3. ALA4877485

    Name:
    N-(thiophen-2-ylmethyl)-4-(p-tolyl)-6-(trifluorome
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    Mol. Formula:
    C17H14F3N3S

    M.W.:
    349.38

    Type:
    Unknown

    AlogP:
    5.14

    Polar Surface Area:
    37.81

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  4. ALA4876175

    Name:
    3-(((4-cyclohexyl-6-(trifluoromethyl)pyrimidin-2-y
    Show More

    Mol. Formula:
    C18H20F3N3O

    M.W.:
    351.37

    Type:
    Unknown

    AlogP:
    4.86

    Polar Surface Area:
    58.04

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  5. ALA4875382

    Name:
    N-(cyclopropylmethyl)-4-(furan-2-yl)-6-(trifluorom
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    Mol. Formula:
    C13H12F3N3O

    M.W.:
    283.25

    Type:
    Unknown

    AlogP:
    3.58

    Polar Surface Area:
    50.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  6. ALA4874462

    Name:
    N-butyl-4-(furan-2-yl)-6-(trifluoromethyl)pyrimidi
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    Mol. Formula:
    C13H14F3N3O

    M.W.:
    285.27

    Type:
    Unknown

    AlogP:
    3.97

    Polar Surface Area:
    50.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  7. ALA4874076

    Name:
    4-(furan-2-yl)-6-(trifluoromethyl)pyrimidine

    Mol. Formula:
    C9H5F3N2O

    M.W.:
    214.15

    Type:
    Unknown

    AlogP:
    2.76

    Polar Surface Area:
    38.92

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.73

    DETAILS
  8. ALA4873870

    Name:
    4-(((4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2
    Show More

    Mol. Formula:
    C16H12F3N3O2

    M.W.:
    335.29

    Type:
    Unknown

    AlogP:
    4.07

    Polar Surface Area:
    71.18

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  9. ALA4872744

    Name:
    4-(furan-2-yl)-N-isopropyl-6-(trifluoromethyl)pyri
    Show More

    Mol. Formula:
    C12H12F3N3O

    M.W.:
    271.24

    Type:
    Unknown

    AlogP:
    3.58

    Polar Surface Area:
    50.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.93

    DETAILS
  10. ALA4871891

    Name:
    4-(furan-2-yl)-N-(4-methoxybenzyl)-6-(trifluoromet
    Show More

    Mol. Formula:
    C17H14F3N3O2

    M.W.:
    349.31

    Type:
    Unknown

    AlogP:
    4.38

    Polar Surface Area:
    60.18

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  11. ALA4871183

    Name:
    N-ethyl-4-(furan-2-yl)-6-(trifluoromethyl)pyrimidi
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    Mol. Formula:
    C11H10F3N3O

    M.W.:
    257.21

    Type:
    Unknown

    AlogP:
    3.19

    Polar Surface Area:
    50.95

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.92

    DETAILS
  12. ALA4870804

    Name:
    4-cyclohexyl-2-(methylsulfonyl)-6-(trifluoromethyl
    Show More

    Mol. Formula:
    C12H15F3N2O2S

    M.W.:
    308.33

    Type:
    Unknown

    AlogP:
    2.95

    Polar Surface Area:
    59.92

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  13. ALA4869460

    Name:
    4-(furan-2-yl)-N-(3-methoxybenzyl)-6-(trifluoromet
    Show More

    Mol. Formula:
    C17H14F3N3O2

    M.W.:
    349.31

    Type:
    Unknown

    AlogP:
    4.38

    Polar Surface Area:
    60.18

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  14. ALA4869274

    Name:
    3-(((4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl)am
    Show More

    Mol. Formula:
    C18H14F3N3O

    M.W.:
    345.32

    Type:
    Unknown

    AlogP:
    4.48

    Polar Surface Area:
    58.04

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  15. ALA5286649

    Name:
    3-(butylthio)quinolin-2-amine

    Mol. Formula:
    C13H16N2S

    M.W.:
    232.35

    Type:
    ---

    AlogP:
    3.71

    Polar Surface Area:
    38.91

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  16. ALA5285458

    Name:

    Mol. Formula:
    C17H17N5O4

    M.W.:
    355.35

    Type:
    ---

    AlogP:
    1.85

    Polar Surface Area:
    117.54

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.68

    DETAILS
  17. ALA5285197

    Name:
    N5-butyl-6-((2-methoxybenzyl)oxy)-1,2,4-triazine-3
    Show More

    Mol. Formula:
    C15H21N5O2

    M.W.:
    303.37

    Type:
    ---

    AlogP:
    2.25

    Polar Surface Area:
    95.18

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  18. ALA5284395

    Name:
    (S)-3-(2-methylbutoxy)quinolin-2-amine

    Mol. Formula:
    C14H18N2O

    M.W.:
    230.31

    Type:
    ---

    AlogP:
    3.24

    Polar Surface Area:
    48.14

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  19. ALA5283757

    Name:
    3-(pent-1-yn-1-yl)quinolin-2-amine

    Mol. Formula:
    C14H14N2

    M.W.:
    210.28

    Type:
    ---

    AlogP:
    2.97

    Polar Surface Area:
    38.91

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    Y

    QED Weighted:
    0.73

    DETAILS
  20. ALA5283490

    Name:
    N-(2-propylthiazolo[4,5-c]quinolin-4-yl)pent-4-yna
    Show More

    Mol. Formula:
    C18H17N3OS

    M.W.:
    323.42

    Type:
    ---

    AlogP:
    4.15

    Polar Surface Area:
    54.88

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
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