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  1. ALA1097973

    Name:
    2-(5-{[(2S)-2-Amino-3-pyridin-4-ylpropyl]oxy}pyrid
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    Mol. Formula:
    C27H26N6O3

    M.W.:
    482.54

    Type:
    Small molecule

    AlogP:
    3.79

    Polar Surface Area:
    131.29

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  2. ALA1097972

    Name:
    2-(5-{[(2S)-2-Amino-3-(3,4-dichlorophenyl)propyl]o
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    Mol. Formula:
    C28H25Cl2N5O3

    M.W.:
    550.45

    Type:
    Small molecule

    AlogP:
    5.70

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  3. ALA1096271

    Name:
    2-(5-{[(2S)-2-Amino-3-(3-chlorophenyl)propyl]oxy}p
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    Mol. Formula:
    C28H26ClN5O3

    M.W.:
    516.00

    Type:
    Small molecule

    AlogP:
    5.05

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  4. ALA1095931

    Name:
    2-(5-{[(2S)-2-Amino-3-(2-chlorophenyl)propyl]oxy}p
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    Mol. Formula:
    C28H26ClN5O3

    M.W.:
    516.00

    Type:
    Small molecule

    AlogP:
    5.05

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  5. ALA1097604

    Name:
    2-(5-{[(2R)-2-Amino-3-(1H-indol-3-yl)propyl]oxy}py
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    Mol. Formula:
    C30H28N6O3

    M.W.:
    520.59

    Type:
    Small molecule

    AlogP:
    4.87

    Polar Surface Area:
    134.19

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  6. ALA1095612

    Name:
    2-(5-{[(2S)-2-Amino-3-(1H-indol-3-yl)propyl]oxy}py
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    Mol. Formula:
    C30H28N6O3

    M.W.:
    520.59

    Type:
    Small molecule

    AlogP:
    4.87

    Polar Surface Area:
    134.19

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  7. ALA1095285

    Name:
    2-[5-({(2R)-2-Amino-3-[3-(trifluoromethyl)phenyl]p
    Show More

    Mol. Formula:
    C29H26F3N5O3

    M.W.:
    549.55

    Type:
    Small molecule

    AlogP:
    5.41

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  8. ALA1098302

    Name:
    2-[5-({(2S)-2-Amino-3-[3-(trifluoromethyl)phenyl]p
    Show More

    Mol. Formula:
    C29H26F3N5O3

    M.W.:
    549.55

    Type:
    Small molecule

    AlogP:
    5.41

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  9. ALA1095622

    Name:
    2-(5-{[(2R)-2-Amino-3-(4-fluorophenyl)propyl]oxy}p
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    Mol. Formula:
    C28H26FN5O3

    M.W.:
    499.55

    Type:
    Small molecule

    AlogP:
    4.53

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  10. ALA1095621

    Name:
    2-(5-{[(2S)-2-Amino-3-(4-fluorophenyl)propyl]oxy}p
    Show More

    Mol. Formula:
    C28H26FN5O3

    M.W.:
    499.55

    Type:
    Small molecule

    AlogP:
    4.53

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  11. ALA1095294

    Name:
    2-(5-{[(2R)-2-Amino-3-phenylpropyl]oxy}pyridin-3-y
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    Mol. Formula:
    C28H27N5O3

    M.W.:
    481.56

    Type:
    Small molecule

    AlogP:
    4.39

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  12. ALA1097602

    Name:
    2-(5-{[(2S)-2-Amino-3-phenylpropyl]oxy}pyridin-3-y
    Show More

    Mol. Formula:
    C28H27N5O3

    M.W.:
    481.56

    Type:
    Small molecule

    AlogP:
    4.39

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  13. ALA1094637

    Name:
    2-(5-{[(2R)-2-Amino-4-methylpentyl]oxy}pyridin-3-y
    Show More

    Mol. Formula:
    C25H29N5O3

    M.W.:
    447.54

    Type:
    Small molecule

    AlogP:
    4.20

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  14. ALA1094321

    Name:
    2-(5-{[(2S)-2-Amino-4-methylpentyl]oxy}pyridin-3-y
    Show More

    Mol. Formula:
    C25H29N5O3

    M.W.:
    447.54

    Type:
    Small molecule

    AlogP:
    4.20

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  15. ALA1094320

    Name:
    2-(5-{[(2R)-2-Aminobutyl]oxy}pyridin-3-yl)-8,9-dim
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    Mol. Formula:
    C23H25N5O3

    M.W.:
    419.49

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  16. ALA1097956

    Name:
    2-(5-{[(2S)-2-Aminobutyl]oxy}pyridin-3-yl)-8,9-dim
    Show More

    Mol. Formula:
    C23H25N5O3

    M.W.:
    419.49

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  17. ALA1097955

    Name:
    2-(5-{[(2R)-2-Aminopropyl]oxy}pyridin-3-yl)-8,9-di
    Show More

    Mol. Formula:
    C22H23N5O3

    M.W.:
    405.46

    Type:
    Small molecule

    AlogP:
    3.17

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  18. ALA1095279

    Name:
    2-(5-{[(2S)-2-Aminopropyl]oxy}pyridin-3-yl)-8,9-di
    Show More

    Mol. Formula:
    C22H23N5O3

    M.W.:
    405.46

    Type:
    Small molecule

    AlogP:
    3.17

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  19. ALA1095278

    Name:
    2-[5-(2-Aminoethoxy)pyridin-3-yl]-8,9-dimethoxyben
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    Mol. Formula:
    C21H21N5O3

    M.W.:
    391.43

    Type:
    Small molecule

    AlogP:
    2.78

    Polar Surface Area:
    118.40

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  20. ALA3735078

    Name:
    (3Z)-N-(2-oxo-(3-(thiophen-2-ylmethylene)indolin-5
    Show More

    Mol. Formula:
    C14H12N2O3S2

    M.W.:
    320.40

    Type:
    Small molecule

    AlogP:
    2.61

    Polar Surface Area:
    75.27

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
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