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  1. ALA4475338

    Name:
    (Z)-2-Imino-5-((5-(4-(trifluoromethyl)phenyl)pyrid
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    Mol. Formula:
    C16H10F3N3OS

    M.W.:
    349.34

    Type:
    Unknown

    AlogP:
    3.91

    Polar Surface Area:
    65.84

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  2. ALA4538609

    Name:
    (Z)-5-((5-(4-(Dimethylamino)phenyl)pyridin-3-yl)me
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    Mol. Formula:
    C17H16N4OS

    M.W.:
    324.41

    Type:
    Unknown

    AlogP:
    2.95

    Polar Surface Area:
    69.08

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  3. ALA4537067

    Name:
    4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[3-[
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    Mol. Formula:
    C35H33N7O2

    M.W.:
    583.70

    Type:
    Unknown

    AlogP:
    6.94

    Polar Surface Area:
    111.28

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  4. ALA4520888

    Name:
    N-[3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]phen
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    Mol. Formula:
    C29H33N9O2

    M.W.:
    539.64

    Type:
    Unknown

    AlogP:
    4.18

    Polar Surface Area:
    131.17

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  5. ALA4533123

    Name:
    3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[3-[
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    Mol. Formula:
    C30H28N8O2

    M.W.:
    532.61

    Type:
    Unknown

    AlogP:
    5.07

    Polar Surface Area:
    127.93

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  6. ALA4571099

    Name:
    4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[3-[
    Show More

    Mol. Formula:
    C30H28N8O2

    M.W.:
    532.61

    Type:
    Unknown

    AlogP:
    5.07

    Polar Surface Area:
    127.93

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  7. ALA4518868

    Name:
    4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[4-m
    Show More

    Mol. Formula:
    C31H30N8O2

    M.W.:
    546.64

    Type:
    Unknown

    AlogP:
    5.38

    Polar Surface Area:
    127.93

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  8. ALA4517979

    Name:
    4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[3-[
    Show More

    Mol. Formula:
    C30H34N8O2

    M.W.:
    538.66

    Type:
    Unknown

    AlogP:
    4.49

    Polar Surface Area:
    127.93

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  9. ALA4572941

    Name:
    4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[4-[
    Show More

    Mol. Formula:
    C30H28N8O2

    M.W.:
    532.61

    Type:
    Unknown

    AlogP:
    5.07

    Polar Surface Area:
    127.93

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  10. ALA5282625

    Name:
    (2R)-2-((3-Cyano-2-(2'-(propan-2-yl)biphenyl-4-yl)
    Show More

    Mol. Formula:
    C28H27N5O

    M.W.:
    449.56

    Type:
    ---

    AlogP:
    5.63

    Polar Surface Area:
    104.69

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  11. ALA5282610

    Name:
    N2-(2-(4-Bromophenyl)-3-cyano-1,7-naphthyridin-4-y
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    Mol. Formula:
    C20H17BrN4O

    M.W.:
    409.29

    Type:
    ---

    AlogP:
    4.08

    Polar Surface Area:
    92.66

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  12. ALA5282526

    Name:
    (2R)-2-((3-Cyano-2-(3'-methoxybiphenyl-4-yl)-1,7-n
    Show More

    Mol. Formula:
    C26H23N5O2

    M.W.:
    437.50

    Type:
    ---

    AlogP:
    4.52

    Polar Surface Area:
    113.92

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  13. ALA5282498

    Name:
    (S)-8-(4-(methylthio)phenyl)-6-oxo-3-(o-tolyl)-2,3
    Show More

    Mol. Formula:
    C22H21N3OS2

    M.W.:
    407.56

    Type:
    ---

    AlogP:
    4.94

    Polar Surface Area:
    47.34

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  14. ALA5282490

    Name:
    N-(3-chloro-4-methoxy-phenyl)-1-(6-methyl-3-pyridy
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    Mol. Formula:
    C18H15ClN6O

    M.W.:
    366.81

    Type:
    ---

    AlogP:
    3.92

    Polar Surface Area:
    77.75

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  15. ALA5282226

    Name:
    (2R)-2-((3-Cyano-2-(2'-fluorobiphenyl-4-yl)-1,7-na
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    Mol. Formula:
    C25H20FN5O

    M.W.:
    425.47

    Type:
    ---

    AlogP:
    4.65

    Polar Surface Area:
    104.69

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  16. ALA5281907

    Name:
    4-amino-3-(5-(thiophen-2-yl)-2H-tetrazol-2-yl)-6,7
    Show More

    Mol. Formula:
    C15H12N6OS2

    M.W.:
    356.44

    Type:
    ---

    AlogP:
    2.36

    Polar Surface Area:
    102.48

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  17. ALA5281763

    Name:
    (2R)-2((3-Cyano-2-(4-(3-methylpyridin-2-yl)phenyl)
    Show More

    Mol. Formula:
    C25H22N6O

    M.W.:
    422.49

    Type:
    ---

    AlogP:
    4.21

    Polar Surface Area:
    117.58

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  18. ALA5281676

    Name:
    (S)-(3-(furan-2-yl)-1H-pyrazol-5-yl)(3-(5-(trifluo
    Show More

    Mol. Formula:
    C20H17F3N6O2

    M.W.:
    430.39

    Type:
    ---

    AlogP:
    3.91

    Polar Surface Area:
    92.84

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  19. ALA5281421

    Name:
    N-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-1H
    Show More

    Mol. Formula:
    C18H13Cl2N5O

    M.W.:
    386.24

    Type:
    ---

    AlogP:
    4.87

    Polar Surface Area:
    64.86

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  20. ALA5281250

    Name:
    N-(4-((7-(3,4-dimethylphenyl)-7H-pyrrolo[2,3-d]pyr
    Show More

    Mol. Formula:
    C22H21N5O

    M.W.:
    371.44

    Type:
    ---

    AlogP:
    4.74

    Polar Surface Area:
    71.84

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
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