The page will load shortly, Thanks for your patience!
View as Grid List

15 Items

Set Ascending Direction
Select all
  1. ALA5277450

    Name:
    Krasilnikolide A

    Mol. Formula:
    C36H58O9

    M.W.:
    634.85

    Type:
    ---

    AlogP:
    4.53

    Polar Surface Area:
    145.91

    HBA:
    9

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  2. ALA5285399

    Name:
    Detalosylkrasilnikolide A

    Mol. Formula:
    C30H48O5

    M.W.:
    488.71

    Type:
    ---

    AlogP:
    5.68

    Polar Surface Area:
    86.99

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  3. ALA5284934

    Name:
    Krasilnikolide B

    Mol. Formula:
    C37H60O9

    M.W.:
    648.88

    Type:
    ---

    AlogP:
    4.92

    Polar Surface Area:
    145.91

    HBA:
    9

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  4. ALA5199613

    Name:
    Marinobactoic Acid

    Mol. Formula:
    C16H18O2

    M.W.:
    242.32

    Type:
    ---

    AlogP:
    3.85

    Polar Surface Area:
    37.30

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  5. ALA5190551

    Name:
    Marinoquinolone B

    Mol. Formula:
    C24H23NO

    M.W.:
    341.45

    Type:
    ---

    AlogP:
    5.46

    Polar Surface Area:
    32.86

    HBA:
    1

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  6. ALA5190319

    Name:
    Sattahipmycin

    Mol. Formula:
    C26H19NO8

    M.W.:
    473.44

    Type:
    ---

    AlogP:
    3.48

    Polar Surface Area:
    153.22

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  7. ALA5170227

    Name:
    rac-Marinoquinolone A

    Mol. Formula:
    C24H23NO2

    M.W.:
    357.45

    Type:
    ---

    AlogP:
    4.73

    Polar Surface Area:
    53.09

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.63

    DETAILS
  8. ALA4637751

    Name:
    Bulbimidazole A

    Mol. Formula:
    C14H24N2O

    M.W.:
    236.36

    Type:
    Unknown

    AlogP:
    3.98

    Polar Surface Area:
    45.75

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  9. ALA4637091

    Name:
    Bulbimidazole B

    Mol. Formula:
    C13H22N2O

    M.W.:
    222.33

    Type:
    Unknown

    AlogP:
    3.73

    Polar Surface Area:
    45.75

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  10. ALA4636496

    Name:
    Bulbimidazole C

    Mol. Formula:
    C13H22N2O

    M.W.:
    222.33

    Type:
    Unknown

    AlogP:
    3.59

    Polar Surface Area:
    45.75

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  11. ALA2419237

    Name:
    2,2,2-Trifluoroethyl-7-(4-methylbenzoyl)-4a,5,6,7-tetrahydropyrrolo[1,2-b]pShow More

    Mol. Formula:
    C18H17F3N2O3

    M.W.:
    366.34

    Type:
    Small molecule

    AlogP:
    2.90

    Polar Surface Area:
    58.97

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  12. ALA2408682

    Name:
    (3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-3Show More

    Mol. Formula:
    C33H52N2O

    M.W.:
    492.79

    Type:
    Small molecule

    AlogP:
    7.84

    Polar Surface Area:
    41.99

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  13. ALA2408679

    Name:
    (3R,5R,8R,9S,10S,13R,14S,17R)-3-(2-(1H-imidazol-1-yl)ethylamino)-10,13-dimeShow More

    Mol. Formula:
    C32H53N3O

    M.W.:
    495.80

    Type:
    Small molecule

    AlogP:
    7.14

    Polar Surface Area:
    46.92

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  14. ALA1081404

    Name:
    2-hydroxy fissinolid

    Mol. Formula:
    C29H38O8

    M.W.:
    514.62

    Type:
    Small molecule

    AlogP:
    4.52

    Polar Surface Area:
    112.27

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  15. ALA1075769

    Name:
    2-Hydroxy-3-O-isobutyrylproceranolide

    Mol. Formula:
    C31H40O9

    M.W.:
    556.65

    Type:
    Small molecule

    AlogP:
    4.48

    Polar Surface Area:
    129.34

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
per page