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

Items 1-20 of 174

Set Ascending Direction
Select all
  1. ALA1091053

    Name:
    (S)-2-amino-2-((S)-6-octyl-1,2,3,4-tetrahydronapht
    Show More

    Mol. Formula:
    C21H35NO

    M.W.:
    317.52

    Type:
    Small molecule

    AlogP:
    4.40

    Polar Surface Area:
    46.25

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  2. ALA1091052

    Name:
    (S)-2-amino-2-((R)-6-octyl-1,2,3,4-tetrahydronapht
    Show More

    Mol. Formula:
    C21H35NO

    M.W.:
    317.52

    Type:
    Small molecule

    AlogP:
    4.40

    Polar Surface Area:
    46.25

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  3. ALA1091051

    Name:
    (R)-2-amino-2-((R)-6-octyl-1,2,3,4-tetrahydronapht
    Show More

    Mol. Formula:
    C21H35NO

    M.W.:
    317.52

    Type:
    Small molecule

    AlogP:
    4.40

    Polar Surface Area:
    46.25

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  4. ALA1090707

    Name:
    (S)-2-amino-2-(6-octyl-1,2,3,4-tetrahydronaphthale
    Show More

    Mol. Formula:
    C21H35NO2

    M.W.:
    333.52

    Type:
    Small molecule

    AlogP:
    3.38

    Polar Surface Area:
    66.48

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  5. ALA4790566

    Name:
    (S)-2-((3-(4-((4-Phenyl-1H-1,2,3-triazol-1-yl)meth
    Show More

    Mol. Formula:
    C23H25ClN8O

    M.W.:
    464.96

    Type:
    Unknown

    AlogP:
    2.94

    Polar Surface Area:
    122.74

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  6. ALA3735192

    Name:
    N'-(3-(benzyloxy)benzylidene)-3,4,5-trihydroxybenz
    Show More

    Mol. Formula:
    C21H18N2O5

    M.W.:
    378.38

    Type:
    Small molecule

    AlogP:
    3.15

    Polar Surface Area:
    111.38

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  7. ALA3736205

    Name:
    3-(4-(2-hydroxyethyl)phenylamino)-1-(4-propoxyphen
    Show More

    Cas Number:
    342406-05-7

    Mol. Formula:
    C21H24N2O4

    M.W.:
    368.43

    Type:
    Small molecule

    AlogP:
    2.75

    Polar Surface Area:
    78.87

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  8. ALA3735039

    Name:
    N-(1H-benzo[d]imidazol-2-yl)tetradecanamide

    Mol. Formula:
    C21H33N3O

    M.W.:
    343.52

    Type:
    Small molecule

    AlogP:
    6.20

    Polar Surface Area:
    57.78

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  9. ALA4548799

    Name:
    (S)-2-(3-(3-fluoro-4-((4-(trifluoromethyl)benzyl)o
    Show More

    Mol. Formula:
    C21H20ClF4N5O2

    M.W.:
    485.87

    Type:
    Unknown

    AlogP:
    4.50

    Polar Surface Area:
    101.26

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  10. ALA4555733

    Name:
    (S)-2-(3-(4'-(trifluoromethyl)-6-((4-(trifluoromet
    Show More

    Mol. Formula:
    C28H24ClF6N5O2

    M.W.:
    611.97

    Type:
    Unknown

    AlogP:
    7.05

    Polar Surface Area:
    101.26

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  11. ALA5208455

    Name:
    [(2R)-1-[[4-[[3-[(4-fluorophenyl)sulfonylmethyl]-5
    Show More

    Mol. Formula:
    C27H30FNO4S

    M.W.:
    483.61

    Type:
    ---

    AlogP:
    4.64

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  12. ALA5206889

    Name:
    [(2R)-1-[7-[3-(benzenesulfonylmethyl)-5-methyl-phe
    Show More

    Mol. Formula:
    C26H37NO4S

    M.W.:
    459.65

    Type:
    ---

    AlogP:
    4.75

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  13. ALA5204905

    Name:
    [(2R)-1-[[4-[[3-[(4-bromophenyl)sulfonylmethyl]-5-
    Show More

    Mol. Formula:
    C27H30BrNO4S

    M.W.:
    544.51

    Type:
    ---

    AlogP:
    5.27

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  14. ALA5202631

    Name:
    [(2R)-1-[[4-[[3-methyl-5-[(4-nitrophenyl)sulfonylm
    Show More

    Mol. Formula:
    C27H30N2O6S

    M.W.:
    510.61

    Type:
    ---

    AlogP:
    4.41

    Polar Surface Area:
    109.98

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  15. ALA5196994

    Name:
    [(2R)-1-[[4-[[3-methyl-5-(p-tolylsulfonylmethyl)ph
    Show More

    Mol. Formula:
    C28H33NO4S

    M.W.:
    479.64

    Type:
    ---

    AlogP:
    4.81

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  16. ALA5192773

    Name:
    [1-[[4-[[3-(benzenesulfonylmethyl)-5-methyl-phenox
    Show More

    Mol. Formula:
    C28H33NO4S

    M.W.:
    479.64

    Type:
    ---

    AlogP:
    4.89

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  17. ALA5192656

    Name:
    [(2R)-1-[[4-[[3-[(4-chlorophenyl)sulfonylmethyl]-5
    Show More

    Mol. Formula:
    C27H30ClNO4S

    M.W.:
    500.06

    Type:
    ---

    AlogP:
    5.16

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  18. ALA5190173

    Name:
    [(2R)-1-[[4-[[3-(cyclopropylsulfonylmethyl)-5-meth
    Show More

    Mol. Formula:
    C24H31NO4S

    M.W.:
    429.58

    Type:
    ---

    AlogP:
    3.61

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  19. ALA5174371

    Name:
    [(2R)-1-[[4-[[3-(benzenesulfonylmethyl)-5-(trifluo
    Show More

    Mol. Formula:
    C27H28F3NO4S

    M.W.:
    519.59

    Type:
    ---

    AlogP:
    5.22

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  20. ALA5171997

    Name:
    2-[[4-[[3-(benzenesulfonylmethyl)-5-methyl-phenoxy
    Show More

    Mol. Formula:
    C25H29NO4S

    M.W.:
    439.58

    Type:
    ---

    AlogP:
    3.97

    Polar Surface Area:
    66.84

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
Page
per page