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

Items 1-20 of 47

Set Ascending Direction
Select all
  1. ALA4581141

    Name:
    (E)-1,3-Dimethoxy-5-(4-(trifluoromethyl)styryl)-2-vinylbenzene

    Mol. Formula:
    C19H17F3O2

    M.W.:
    334.34

    Type:
    Unknown

    AlogP:
    5.54

    Polar Surface Area:
    18.46

    HBA:
    2

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  2. ALA4173836

    Name:
    (2S)-2-[5-(3-chlorobenzyl)-2-oxooxazolidin-3-yl]-4-methyl-N-[(S)-1-oxo-3-{(Show More

    Mol. Formula:
    C23H30ClN3O5

    M.W.:
    463.96

    Type:
    Small molecule

    AlogP:
    2.33

    Polar Surface Area:
    104.81

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  3. ALA4166569

    Name:
    Sodium (2S)-2-{(2S)-2-[5-(3-chlorobenzyl)-2-oxooxazolidin-3-yl]-4-methylpenShow More

    Mol. Formula:
    C23H31ClN3NaO8S

    M.W.:
    568.02

    Type:
    Small molecule

    AlogP:
    1.34

    Polar Surface Area:
    162.34

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  4. ALA4105106

    Name:
    sodium-(5S,8S)-1-(3-Chlorophenyl)-11-cyclohexyl-5-(cyclohexylmethyl)-3,6,11Show More

    Mol. Formula:
    C31H43ClN3NaO9S

    M.W.:
    692.21

    Type:
    Small molecule

    AlogP:
    4.25

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  5. ALA4103451

    Name:
    3-Chlorophenethyl ((S)-3-cyclohexyl-1-oxo-1-(((S)-1-oxo-3-((S)-2-oxopyrroliShow More

    Mol. Formula:
    C25H34ClN3O5

    M.W.:
    492.02

    Type:
    Small molecule

    AlogP:
    3.16

    Polar Surface Area:
    113.60

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  6. ALA4101004

    Name:
    Sodium (8S,11S)-8-(cyclohexylmethyl)-12-hydroxy-6,9-dioxo-11-(((S)-2-oxo-pyShow More

    Mol. Formula:
    C26H38N3NaO9S

    M.W.:
    591.66

    Type:
    Small molecule

    AlogP:
    1.49

    Polar Surface Area:
    180.36

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  7. ALA4098228

    Name:
    sodium-(5S,8S)-5-Isobutyl-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3-yl)-methyShow More

    Mol. Formula:
    C23H32N3NaO9S

    M.W.:
    549.58

    Type:
    Small molecule

    AlogP:
    1.12

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  8. ALA4097398

    Name:
    sodium-(5S,8S)-5-(cyclohexylmethyl)-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3Show More

    Mol. Formula:
    C30H44N3NaO9S

    M.W.:
    645.75

    Type:
    Small molecule

    AlogP:
    3.60

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  9. ALA4097319

    Name:
    sodium-(5S,8S)-5-Isobutyl-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3-yl)-methyShow More

    Mol. Formula:
    C29H44N3NaO9S

    M.W.:
    633.74

    Type:
    Small molecule

    AlogP:
    3.46

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  10. ALA4095692

    Name:
    2-(benzyloxy)ethyl ((S)-3-cyclohexyl-1-oxo-1-(((S)-1-oxo-3-((S)-2-oxopyrrolShow More

    Mol. Formula:
    C26H37N3O6

    M.W.:
    487.60

    Type:
    Small molecule

    AlogP:
    2.48

    Polar Surface Area:
    122.83

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  11. ALA4093269

    Name:
    Sodium (2S)-2-((S)-3-cyclohexyl-2-undecanamidopropanamido)-1-hydroxy-3-((S)Show More

    Mol. Formula:
    C27H48N3NaO8S

    M.W.:
    597.75

    Type:
    Small molecule

    AlogP:
    3.41

    Polar Surface Area:
    171.13

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  12. ALA4091852

    Name:
    (4S,7S)-17-Benzyl-4-isobutyl-2,5,10-trioxo-1-oxa-3,6,11-triazacycloheptadecShow More

    Mol. Formula:
    C25H37N3O5

    M.W.:
    459.59

    Type:
    Small molecule

    AlogP:
    2.89

    Polar Surface Area:
    113.60

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  13. ALA4090885

    Name:
    sodium-(5S,8S)-5-Isobutyl-3,6,11,14-tetraoxo-8-(((S)-2-oxopyrrolidin-3-yl)mShow More

    Mol. Formula:
    C25H35N4NaO11S

    M.W.:
    622.63

    Type:
    Small molecule

    AlogP:
    0.45

    Polar Surface Area:
    215.53

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  14. ALA4089599

    Name:
    sodium-(5S,8S)-5-Isobutyl-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3-yl)-methyShow More

    Mol. Formula:
    C26H38N3NaO9S

    M.W.:
    591.66

    Type:
    Small molecule

    AlogP:
    2.29

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  15. ALA4088757

    Name:
    sodium-(5S,8S)-1-(3-Chlorophenyl)-5-(cyclohexylmethyl)-12-methyl-3,6,11-triShow More

    Mol. Formula:
    C28H39ClN3NaO9S

    M.W.:
    652.14

    Type:
    Small molecule

    AlogP:
    3.33

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  16. ALA4088437

    Name:
    sodium-(5S,8S)-5-(Cyclohexylmethyl)-13-methyl-3,6,11,14-tetraoxo-8-(((S)-2-Show More

    Mol. Formula:
    C29H41N4NaO11S

    M.W.:
    676.72

    Type:
    Small molecule

    AlogP:
    1.76

    Polar Surface Area:
    215.53

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  17. ALA4086271

    Name:
    sodium-(5S,8S)-5-Isobutyl-12-methyl-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3Show More

    Mol. Formula:
    C25H36N3NaO9S

    M.W.:
    577.63

    Type:
    Small molecule

    AlogP:
    1.75

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  18. ALA4085523

    Name:
    Sodium (2S)-2-((S)-3-cyclohexyl-2-(octylsulfonamido)propanamido)-1-hydroxy-Show More

    Mol. Formula:
    C24H44N3NaO8S2

    M.W.:
    589.75

    Type:
    Small molecule

    AlogP:
    1.82

    Polar Surface Area:
    178.97

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  19. ALA4083097

    Name:
    sodium-(5S,8S)-5-Isobutyl-13-isopropyl-3,6,11,14-tetraoxo-8-(((S)-2-oxopyrrShow More

    Mol. Formula:
    C28H41N4NaO11S

    M.W.:
    664.71

    Type:
    Small molecule

    AlogP:
    1.48

    Polar Surface Area:
    215.53

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  20. ALA4081729

    Name:
    sodium-(5S,8S)-5-Isobutyl-3,6,11-trioxo-8-(((S)-2-oxopyrrolidin-3-yl)-methyShow More

    Mol. Formula:
    C24H34N3NaO9S

    M.W.:
    563.61

    Type:
    Small molecule

    AlogP:
    1.51

    Polar Surface Area:
    177.20

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
Page
per page