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  1. ALA1790704

    Name:
    (S)-2-((R)-2-{[(3S,6S,12R)-12-(3-Guanidino-propyl)
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    Mol. Formula:
    C38H60N8O8

    M.W.:
    756.95

    Type:
    Small molecule

    AlogP:
    1.34

    Polar Surface Area:
    247.64

    HBA:
    8

    HBD:
    7

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  2. ALA1790701

    Name:
    (S)-2-{(R)-2-[((3S,6S)-5,11-Dioxo-17-oxa-4,10-diaz
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    Mol. Formula:
    C32H48N4O7

    M.W.:
    600.76

    Type:
    Small molecule

    AlogP:
    2.80

    Polar Surface Area:
    154.14

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  3. ALA38243

    Name:
    4-Methyl-N-[2-(3-oxo-1-phenyl-1,3-dihydro-isobenzo
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    Mol. Formula:
    C23H22N2O4S

    M.W.:
    422.51

    Type:
    Small molecule

    AlogP:
    2.93

    Polar Surface Area:
    84.50

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  4. ALA25222

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[5-(7-Amino-heptyloxy)-3-
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    Mol. Formula:
    C47H71F3N6O9

    M.W.:
    921.11

    Type:
    Small molecule

    AlogP:
    6.49

    Polar Surface Area:
    221.89

    HBA:
    8

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    29

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  5. ALA21413

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[7-(7-Amino-heptyloxy)-3-
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    Mol. Formula:
    C47H71F3N6O9

    M.W.:
    921.11

    Type:
    Small molecule

    AlogP:
    6.49

    Polar Surface Area:
    221.89

    HBA:
    8

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    29

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  6. ALA281143

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[3-(7-Amino-heptyl)-7-(6-
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    Mol. Formula:
    C45H67F3N6O9

    M.W.:
    893.06

    Type:
    Small molecule

    AlogP:
    5.71

    Polar Surface Area:
    221.89

    HBA:
    8

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    27

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  7. ALA283803

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[3-(7-Amino-heptyl)-5-(6-
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    Mol. Formula:
    C45H67F3N6O9

    M.W.:
    893.06

    Type:
    Small molecule

    AlogP:
    5.71

    Polar Surface Area:
    221.89

    HBA:
    8

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    27

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  8. ALA21448

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[3-(6-Guanidino-hexyl)-7-
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    Mol. Formula:
    C45H67F3N10O9

    M.W.:
    949.09

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    298.65

    HBA:
    8

    HBD:
    10

    #RO5 Violations:
    2

    #Rotatable Bonds:
    27

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  9. ALA265064

    Name:
    (S)-2-{(2S,3S)-2-[(S)-2-{[3-(6-Guanidino-hexyl)-5-
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    Mol. Formula:
    C45H67F3N10O9

    M.W.:
    949.09

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    298.65

    HBA:
    8

    HBD:
    10

    #RO5 Violations:
    2

    #Rotatable Bonds:
    27

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
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