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  1. ALA5171045

    Name:
    N-(3-(2-((4-(4-(12-(2-((3r,5r,7r)-Adamantan-1-yl)-N-(prop-2-yn-1-yl)acetamiShow More

    Mol. Formula:
    C56H74N8O4

    M.W.:
    923.26

    Type:
    ---

    AlogP:
    10.28

    Polar Surface Area:
    124.93

    HBA:
    10

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    23

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  2. ALA2177837

    Name:
    N-(4-(2-(2-Aminopyridin-3-yl)-5-(pyridin-3-yl)-3H-imidazo-[4,5-b]pyridin-3-Show More

    Mol. Formula:
    C30H22FN7O

    M.W.:
    515.55

    Type:
    Small molecule

    AlogP:
    5.20

    Polar Surface Area:
    111.61

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  3. ALA2177836

    Name:
    N-(4-(5-(3-Acetamidophenyl)-2-(2-aminopyridin-3-yl)-3Himidazo[4,5-b]pyridinShow More

    Mol. Formula:
    C33H26FN7O2

    M.W.:
    571.62

    Type:
    Small molecule

    AlogP:
    5.76

    Polar Surface Area:
    127.82

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  4. ALA2177835

    Name:
    N-(4-(2-(2-Aminopyridin-3-yl)-5-phenyl-3H-imidazo[4,5-b]-pyridin-3-yl)benzyShow More

    Mol. Formula:
    C31H24N6O

    M.W.:
    496.57

    Type:
    Small molecule

    AlogP:
    5.66

    Polar Surface Area:
    98.72

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  5. ALA2177834

    Name:
    N-(4-(5-(3-Acetamidophenyl)-2-(2-aminopyridin-3-yl)-3Himidazo[4,5-b]pyridinShow More

    Mol. Formula:
    C33H27N7O2

    M.W.:
    553.63

    Type:
    Small molecule

    AlogP:
    5.62

    Polar Surface Area:
    127.82

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  6. ALA2177832

    Name:
    N-(4-(2-(2-Aminopyridin-3-yl)-5-(pyridin-3-yl)-3H-imidazo-[4,5-b]pyridin-3-Show More

    Mol. Formula:
    C30H23N7O

    M.W.:
    497.56

    Type:
    Small molecule

    AlogP:
    5.06

    Polar Surface Area:
    111.61

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  7. ALA2177830

    Name:
    N-(4-(2-(2-Aminopyridin-3-yl)-6-phenyl-3H-imidazo[4,5-b]-pyridin-3-yl)benzyShow More

    Mol. Formula:
    C31H24N6O

    M.W.:
    496.57

    Type:
    Small molecule

    AlogP:
    5.66

    Polar Surface Area:
    98.72

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  8. ALA2177829

    Name:
    2-(4-(2-(2-Aminopyridin-3-yl)-5-(pyridin-3-yl)-3H-imidazo-[4,5-b]pyridin-3-Show More

    Mol. Formula:
    C30H23N7O

    M.W.:
    497.56

    Type:
    Small molecule

    AlogP:
    5.31

    Polar Surface Area:
    111.61

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  9. ALA2177828

    Name:
    2-(4-(5-(3-Acetamidophenyl)-2-(2-aminopyridin-3-yl)-3Himidazo[4,5-b]pyridinShow More

    Mol. Formula:
    C33H26FN7O2

    M.W.:
    571.62

    Type:
    Small molecule

    AlogP:
    6.01

    Polar Surface Area:
    127.82

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  10. ALA2177827

    Name:
    3-(3-(4-(Aminomethyl)phenyl)-5-phenyl-3H-imidazo[4,5-b]-pyridin-2-yl)pyridiShow More

    Mol. Formula:
    C33H27N7O2

    M.W.:
    553.63

    Type:
    Small molecule

    AlogP:
    5.87

    Polar Surface Area:
    127.82

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  11. ALA2177826

    Name:
    N-(4-(2-(2-aminopyridin-3-yl)-6-cyclopentyl-3H-imidazo[4,5-b]pyridin-3-yl)bShow More

    Mol. Formula:
    C30H28N6O

    M.W.:
    488.60

    Type:
    Small molecule

    AlogP:
    5.65

    Polar Surface Area:
    98.72

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  12. ALA2177819

    Name:
    N-(4-(2-(2-Aminopyridin-3-yl)-3H-imidazo[4,5-b]pyridin-3-yl)benzyl)benzamidShow More

    Mol. Formula:
    C25H20N6O

    M.W.:
    420.48

    Type:
    Small molecule

    AlogP:
    3.99

    Polar Surface Area:
    98.72

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  13. ALA2177818

    Name:
    2-(4-(2-(2-Aminopyridin-3-yl)-3H-imidazo[4,5-b]pyridin-3-yl)phenyl)-N-phenyShow More

    Mol. Formula:
    C25H20N6O

    M.W.:
    420.48

    Type:
    Small molecule

    AlogP:
    4.25

    Polar Surface Area:
    98.72

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  14. ALA2023845

    Name:
    3-((11R,14R,17R,20R,23R,26R,34R)-38-amino-26-carbamoyl-11,14,17,20,23-pentaShow More

    Mol. Formula:
    C84H130N32O14S

    M.W.:
    1844.24

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  15. ALA2023842

    Name:
    N-((6R,9R,19R)-1,23-diamino-6-carbamoyl-9-(3-guanidinopropyl)-1-imino-8,11,Show More

    Mol. Formula:
    C46H79N15O7S

    M.W.:
    986.30

    Type:
    Small molecule

    AlogP:
    0.54

    Polar Surface Area:
    362.82

    HBA:
    12

    HBD:
    12

    #RO5 Violations:
    3

    #Rotatable Bonds:
    34

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  16. ALA2023841

    Name:
    ARC-1083

    Mol. Formula:
    C105H168N37O16S2+

    M.W.:
    2268.88

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  17. ALA2002553

    Name:
    SID103905289

    Mol. Formula:
    C8H6N2O3S

    M.W.:
    210.21

    Type:
    Small molecule

    AlogP:
    0.99

    Polar Surface Area:
    83.05

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
  18. ALA1997759

    Name:
    SID103904675

    Mol. Formula:
    C20H16N4O2

    M.W.:
    344.37

    Type:
    Small molecule

    AlogP:
    3.66

    Polar Surface Area:
    68.52

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  19. ALA1996604

    Name:
    SID103905211

    Mol. Formula:
    C18H16N2O3S

    M.W.:
    340.40

    Type:
    Small molecule

    AlogP:
    3.60

    Polar Surface Area:
    59.92

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.86

    DETAILS
  20. ALA1995448

    Name:
    SID103904733

    Mol. Formula:
    C12H15N5O

    M.W.:
    245.29

    Type:
    Small molecule

    AlogP:
    1.14

    Polar Surface Area:
    99.08

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.73

    DETAILS
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