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  1. ALA4870540

    Name:
    Physachenolide C

    Mol. Formula:
    C30H40O9

    M.W.:
    544.64

    Type:
    Unknown

    AlogP:
    2.30

    Polar Surface Area:
    142.89

    HBA:
    9

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  2. ALA1098066

    Name:
    (2R*,3S*,4R*,6S*)-2-(4-Fluorophenyl)tetrahydro-3,4
    Show More

    Mol. Formula:
    C25H22FNO2S

    M.W.:
    419.52

    Type:
    Small molecule

    AlogP:
    5.54

    Polar Surface Area:
    53.25

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  3. ALA1096037

    Name:
    (2S*,4R*,6R*)-2-((Ethylthio)methyl)-6-(4-fluorophe
    Show More

    Mol. Formula:
    C20H23FO2S

    M.W.:
    346.47

    Type:
    Small molecule

    AlogP:
    4.69

    Polar Surface Area:
    29.46

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.85

    DETAILS
  4. ALA4546951

    Name:
    ((6S,7aR)-6-Allyl-7a-((R)-1-(4-methoxyphenyl)propa
    Show More

    Mol. Formula:
    C20H24O4

    M.W.:
    328.41

    Type:
    Unknown

    AlogP:
    3.67

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  5. ALA4546922

    Name:
    (2-(6-Fluoro-1H-indol-3-yl)-1H-imidazol-4-yl)(3,4,
    Show More

    Mol. Formula:
    C21H18FN3O4

    M.W.:
    395.39

    Type:
    Unknown

    AlogP:
    3.95

    Polar Surface Area:
    89.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  6. ALA4550982

    Name:
    (2-(4-Methyl-1H-indol-3-yl)-1H-imidazol-4-yl)(3,4,
    Show More

    Mol. Formula:
    C22H21N3O4

    M.W.:
    391.43

    Type:
    Unknown

    AlogP:
    4.12

    Polar Surface Area:
    89.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  7. ALA4524729

    Name:
    ((6S,7aR)-6-Allyl-7a-((R)-1-(2,5-difluoro-4-methox
    Show More

    Mol. Formula:
    C20H22F2O4

    M.W.:
    364.39

    Type:
    Unknown

    AlogP:
    3.94

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  8. ALA4560939

    Name:
    ((6S,7aR)-6-Allyl-7a-(1-(4-fluorophenyl)propan-2-y
    Show More

    Mol. Formula:
    C19H21FO3

    M.W.:
    316.37

    Type:
    Unknown

    AlogP:
    3.80

    Polar Surface Area:
    35.53

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  9. ALA4560897

    Name:
    (2-(4-Fluoro-1H-indol-3-yl)-1H-imidazol-4-yl)(3,4,
    Show More

    Mol. Formula:
    C21H18FN3O4

    M.W.:
    395.39

    Type:
    Unknown

    AlogP:
    3.95

    Polar Surface Area:
    89.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  10. ALA4556672

    Name:
    (N-(5-((S)-2-((3aR,5S)-5-Allyl-6-oxo-3a,4,5,6-tetr
    Show More

    Mol. Formula:
    C22H26FNO5

    M.W.:
    403.45

    Type:
    Unknown

    AlogP:
    3.76

    Polar Surface Area:
    73.86

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  11. ALA4556495

    Name:
    ((6S,7aR)-6-Allyl-7a-((S)-1-(3-methoxyphenyl)propa
    Show More

    Mol. Formula:
    C20H24O4

    M.W.:
    328.41

    Type:
    Unknown

    AlogP:
    3.67

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  12. ALA4553192

    Name:
    ((6S,7aR)-6-Allyl-7a-((S)-1-(2,5-difluoro-4-methox
    Show More

    Mol. Formula:
    C20H22F2O4

    M.W.:
    364.39

    Type:
    Unknown

    AlogP:
    3.94

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  13. ALA4760862

    Name:
    N-(4-isopropylphenyl)-5-(3-morpholinopropoxy)quino
    Show More

    Mol. Formula:
    C25H31N3O2

    M.W.:
    405.54

    Type:
    Unknown

    AlogP:
    5.20

    Polar Surface Area:
    46.62

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  14. ALA4539078

    Name:
    ((6S,7aR)-6-Allyl-7a-((R)-1-(2,6-difluoro-4-methox
    Show More

    Mol. Formula:
    C20H22F2O4

    M.W.:
    364.39

    Type:
    Unknown

    AlogP:
    3.94

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.72

    DETAILS
  15. ALA4537874

    Name:
    ((6S,7aR)-6-Allyl-7a-((S)-1-(3-chloro-4-methoxyphe
    Show More

    Mol. Formula:
    C20H23ClO4

    M.W.:
    362.85

    Type:
    Unknown

    AlogP:
    4.32

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  16. ALA4537016

    Name:
    5-Acetyl-N-(4-amino-2-(methylthio)-6-oxo-1,6-dihyd
    Show More

    Mol. Formula:
    C14H16N4O5S2

    M.W.:
    384.44

    Type:
    Unknown

    AlogP:
    1.09

    Polar Surface Area:
    144.24

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  17. ALA4536068

    Name:
    ((6S,7aR)-6-Allyl-7a-((S)-1-(4-methoxyphenyl)propa
    Show More

    Mol. Formula:
    C20H24O4

    M.W.:
    328.41

    Type:
    Unknown

    AlogP:
    3.67

    Polar Surface Area:
    44.76

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.75

    DETAILS
  18. ALA4530505

    Name:
    (2-(1H-Indol-6-yl)-1H-imidazol-4-yl)(3,4,5-trimeth
    Show More

    Mol. Formula:
    C21H19N3O4

    M.W.:
    377.40

    Type:
    Unknown

    AlogP:
    3.81

    Polar Surface Area:
    89.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  19. ALA4529824

    Name:
    (2-(6-(Benzyloxy)-1H-indol-3-yl)-1H-imidazol-4-yl)
    Show More

    Mol. Formula:
    C28H25N3O5

    M.W.:
    483.52

    Type:
    Unknown

    AlogP:
    5.39

    Polar Surface Area:
    98.46

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  20. ALA4529244

    Name:
    (2-(1H-Indol-5-yl)-1H-imidazol-4-yl)(3,4,5-trimeth
    Show More

    Mol. Formula:
    C21H19N3O4

    M.W.:
    377.40

    Type:
    Unknown

    AlogP:
    3.81

    Polar Surface Area:
    89.23

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
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