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  1. ALA4874624

    Name:
    Oregonin

    Mol. Formula:
    C24H30O10

    M.W.:
    478.49

    Type:
    Unknown

    AlogP:
    0.86

    Polar Surface Area:
    177.14

    HBA:
    10

    HBD:
    7

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  2. ALA4870289

    Name:
    Giffonin W

    Mol. Formula:
    C19H20O7

    M.W.:
    360.36

    Type:
    Unknown

    AlogP:
    -0.12

    Polar Surface Area:
    138.45

    HBA:
    7

    HBD:
    6

    #RO5 Violations:
    1

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  3. ALA4869793

    Name:
    Giffonin K

    Mol. Formula:
    C21H22O6

    M.W.:
    370.40

    Type:
    Unknown

    AlogP:
    3.57

    Polar Surface Area:
    88.38

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  4. ALA4868561

    Name:
    Giffonin X

    Mol. Formula:
    C19H20O5

    M.W.:
    328.36

    Type:
    Unknown

    AlogP:
    1.93

    Polar Surface Area:
    97.99

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  5. ALA4867521

    Name:
    Giffonin N

    Mol. Formula:
    C25H30O10

    M.W.:
    490.51

    Type:
    Unknown

    AlogP:
    -0.24

    Polar Surface Area:
    177.14

    HBA:
    10

    HBD:
    7

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  6. ALA4864244

    Name:
    Carpinotriol B

    Mol. Formula:
    C19H20O6

    M.W.:
    344.36

    Type:
    Unknown

    AlogP:
    0.91

    Polar Surface Area:
    118.22

    HBA:
    6

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  7. ALA4864040

    Name:
    Alnusone

    Mol. Formula:
    C19H18O3

    M.W.:
    294.35

    Type:
    Unknown

    AlogP:
    3.77

    Polar Surface Area:
    57.53

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  8. ALA1078314

    Name:
    GGTTGGTGTGGTTGG

    Mol. Formula:
    C150H187N57O103P14

    M.W.:
    4870.08

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA4849304

    Name:
    Giffonin J

    Mol. Formula:
    C21H24O6

    M.W.:
    372.42

    Type:
    Unknown

    AlogP:
    3.79

    Polar Surface Area:
    88.38

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.74

    DETAILS
  10. ALA4782167

    Name:
    NA

    Mol. Formula:
    C112H153N5Na22O151S22

    M.W.:
    5196.59

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA4782067

    Name:
    NA

    Mol. Formula:
    C151H187F3N57O97P15

    M.W.:
    4874.06

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA4781858

    Name:
    N-((1R,2S)-2-(3,4-difluorophenyl)cyclopropyl)-3-et
    Show More

    Mol. Formula:
    C16H16F2N6S

    M.W.:
    362.41

    Type:
    Unknown

    AlogP:
    3.21

    Polar Surface Area:
    68.52

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  13. ALA4777932

    Name:
    (1S,2R,3S,4R)-4-(5-chloro-7-(((1R,2S)-2-(3,4-diflu
    Show More

    Mol. Formula:
    C18H17ClF2N6O3

    M.W.:
    438.82

    Type:
    Unknown

    AlogP:
    1.15

    Polar Surface Area:
    129.21

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  14. ALA4777212

    Name:
    (5-Amino-3-(pyridin-2-yl)-1H-1,2,4-triazol-1-yl)(3
    Show More

    Mol. Formula:
    C16H15N5O

    M.W.:
    293.33

    Type:
    Unknown

    AlogP:
    2.23

    Polar Surface Area:
    86.69

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  15. ALA4776800

    Name:
    NA

    Mol. Formula:
    C52H72N2Na10O69S10

    M.W.:
    2379.66

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA4776259

    Name:
    (5-Amino-3-(pyridin-2-yl)-1H-1,2,4-triazol-1-yl)(n
    Show More

    Mol. Formula:
    C18H13N5O

    M.W.:
    315.34

    Type:
    Unknown

    AlogP:
    2.76

    Polar Surface Area:
    86.69

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  17. ALA5206023

    Name:
    (S)-4-amino-2-((3R,6S,9S,12S,15R,E)-15-((3S,6S,9S,
    Show More

    Mol. Formula:
    C84H138N24O29S4

    M.W.:
    2076.44

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA5202369

    Name:
    (S)-2-((3R,6S,9S,12S,15R,E)-9-((1H-imidazol-5-yl)m
    Show More

    Mol. Formula:
    C90H147N27O29S4

    M.W.:
    2199.59

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  19. ALA5199320

    Name:
    (S)-1-((3R,6S,9S,12R)-12-((3S,6S,9S,12S,15S,18S)-1
    Show More

    Mol. Formula:
    C97H142N28O26S4

    M.W.:
    2244.64

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  20. ALA5198001

    Name:
    (S)-1-((3R,6S,9S,12R)-12-((S)-2-((S)-1-((3S,6S,9S,
    Show More

    Mol. Formula:
    C82H131N27O24S5

    M.W.:
    2039.45

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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