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  1. ALA5206579

    Name:
    N-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-2-((S)-1-(N-hydroxyforShow More

    Mol. Formula:
    C21H33N3O4

    M.W.:
    391.51

    Type:
    ---

    AlogP:
    2.14

    Polar Surface Area:
    98.74

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  2. ALA4435465

    Name:
    (R)-N-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-2-((S)-1-(N-hydroxShow More

    Mol. Formula:
    C22H35N3O4

    M.W.:
    405.54

    Type:
    Unknown

    AlogP:
    2.53

    Polar Surface Area:
    98.74

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  3. ALA3770935

    Name:
    (S)-3-((4-(4-Cyano-2-methylphenyl)piperazin-1-yl)sulfonyl)-N-hydroxythiazolShow More

    Mol. Formula:
    C16H21N5O4S2

    M.W.:
    411.51

    Type:
    Small molecule

    AlogP:
    0.11

    Polar Surface Area:
    116.98

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  4. ALA3704910

    Name:
    US9115102, Ex14::US9115102, Ex24

    Mol. Formula:
    C26H31N5O6S

    M.W.:
    541.63

    Type:
    Small molecule

    AlogP:
    1.30

    Polar Surface Area:
    141.17

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  5. GI254023X

    Name:
    (R)-N-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-2-((S)-1-(N-hydroxShow More

    Mol. Formula:
    C21H33N3O4

    M.W.:
    391.51

    Type:
    Small molecule

    AlogP:
    2.14

    Polar Surface Area:
    98.74

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  6. ALA506057

    Name:
    (1S,2R)-N-hydroxy-2-((S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl)-2-(4-((2-Show More

    Mol. Formula:
    C33H33N3O5

    M.W.:
    551.64

    Type:
    Small molecule

    AlogP:
    4.52

    Polar Surface Area:
    111.99

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  7. ALA496309

    Name:
    (1R,2S)-1-(3-fluoro-4-((2-phenylquinolin-4-yl)methoxy)benzyl)-N2-hydroxy-N1Show More

    Mol. Formula:
    C30H28FN3O4

    M.W.:
    513.57

    Type:
    Small molecule

    AlogP:
    4.76

    Polar Surface Area:
    91.76

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  8. ALA484261

    Name:
    (2R,3S)-2-(4-(but-2-ynyloxy)phenylsulfonamido)-N,3-dihydroxybutanamide

    Mol. Formula:
    C14H18N2O6S

    M.W.:
    342.37

    Type:
    Small molecule

    AlogP:
    -0.38

    Polar Surface Area:
    124.96

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  9. ALA398743

    Name:
    (R)-pyrrolidin-2-ylmethyl 4-((4-(4-cyano-2-methylphenyl)-5,6-dihydropyridinShow More

    Mol. Formula:
    C26H35N5O6S

    M.W.:
    545.66

    Type:
    Small molecule

    AlogP:
    1.76

    Polar Surface Area:
    152.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  10. ALA253652

    Name:
    (S)-pyrrolidin-2-ylmethyl 4-((4-(4-cyano-2-methylphenyl)-5,6-dihydropyridinShow More

    Mol. Formula:
    C26H35N5O6S

    M.W.:
    545.66

    Type:
    Small molecule

    AlogP:
    1.76

    Polar Surface Area:
    152.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  11. ALA400528

    Name:
    pyrrolidin-3-yl 4-((4-(4-cyano-2-methylphenyl)piperidin-1-ylsulfonyl)methylShow More

    Mol. Formula:
    C25H35N5O6S

    M.W.:
    533.65

    Type:
    Small molecule

    AlogP:
    1.46

    Polar Surface Area:
    152.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  12. ALA253230

    Name:
    (R)-pyrrolidin-2-ylmethyl 4-((4-(4-cyano-2-methylphenyl)piperidin-1-ylsulfoShow More

    Mol. Formula:
    C26H37N5O6S

    M.W.:
    547.68

    Type:
    Small molecule

    AlogP:
    1.85

    Polar Surface Area:
    152.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  13. ALA253021

    Name:
    (S)-pyrrolidin-2-ylmethyl 4-((4-(4-cyano-2-methylphenyl)piperidin-1-ylsulfoShow More

    Mol. Formula:
    C26H37N5O6S

    M.W.:
    547.68

    Type:
    Small molecule

    AlogP:
    1.85

    Polar Surface Area:
    152.07

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  14. ALA253020

    Name:
    (R)-pyrrolidin-2-ylmethyl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidin-1-ylsShow More

    Mol. Formula:
    C25H38N4O6S

    M.W.:
    522.67

    Type:
    Small molecule

    AlogP:
    1.98

    Polar Surface Area:
    128.28

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  15. ALA253019

    Name:
    (S)-pyrrolidin-2-ylmethyl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidin-1-ylsShow More

    Mol. Formula:
    C25H38N4O6S

    M.W.:
    522.67

    Type:
    Small molecule

    AlogP:
    1.98

    Polar Surface Area:
    128.28

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  16. ALA252612

    Name:
    pyrrolidin-3-yl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidin-1-ylsulfonyl)meShow More

    Mol. Formula:
    C24H36N4O6S

    M.W.:
    508.64

    Type:
    Small molecule

    AlogP:
    1.59

    Polar Surface Area:
    128.28

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  17. (2-hydroxycyclopentyl) 4-(hydroxycarbamoyl)-4-[[4-(2-methylphenyl)piperidin-1-yl]sulfonylmethyl]piperidine-1-carboxylate

    Name:
    trans-2-hydroxycyclopentyl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidin-1-ylShow More

    Mol. Formula:
    C25H37N3O7S

    M.W.:
    523.65

    Type:
    Small molecule

    AlogP:
    2.14

    Polar Surface Area:
    136.48

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  18. ALA439405

    Name:
    4,4-dimethyl-tetrahydrofuran-3-yl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidShow More

    Mol. Formula:
    C26H39N3O7S

    M.W.:
    537.68

    Type:
    Small molecule

    AlogP:
    2.65

    Polar Surface Area:
    125.48

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  19. ALA254492

    Name:
    3-methyl-tetrahydrofuran-3-yl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperidin-1Show More

    Mol. Formula:
    C25H37N3O7S

    M.W.:
    523.65

    Type:
    Small molecule

    AlogP:
    2.41

    Polar Surface Area:
    125.48

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  20. ALA251830

    Name:
    (S)-tetrahydrofuran-3-yl 4-((4-(4-cyano-2-methylphenyl)-5,6-dihydropyridin-Show More

    Mol. Formula:
    C25H32N4O7S

    M.W.:
    532.62

    Type:
    Small molecule

    AlogP:
    1.80

    Polar Surface Area:
    149.27

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
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