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

Items 1-20 of 1,052

Set Ascending Direction
Select all
  1. ALA4535253

    Name:
    Withaphysalin C

    Mol. Formula:
    C28H36O7

    M.W.:
    484.59

    Type:
    Unknown

    AlogP:
    3.49

    Polar Surface Area:
    102.29

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  2. ALA4534630

    Name:
    (1R,4aS,10aR)-methyl 6-acetyl-7-isopropyl-1,4a-dim
    Show More

    Mol. Formula:
    C23H32O3

    M.W.:
    356.51

    Type:
    Unknown

    AlogP:
    5.20

    Polar Surface Area:
    43.37

    HBA:
    3

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  3. ALA4532052

    Name:
    5-(pentafluoro-lambda6-sulfanyl)-3-(1H-pyrrol-2-yl
    Show More

    Mol. Formula:
    C13H9F5N2OS

    M.W.:
    336.29

    Type:
    Unknown

    AlogP:
    5.16

    Polar Surface Area:
    44.89

    HBA:
    1

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  4. ALA4558045

    Name:
    Withaphysalin X

    Mol. Formula:
    C28H36O8

    M.W.:
    500.59

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    122.52

    HBA:
    8

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  5. ALA4570681

    Name:
    N,N'-(1,3-phenylenebis(methylene))bis(4-nitrobenze
    Show More

    Mol. Formula:
    C20H18N4O8S2

    M.W.:
    506.52

    Type:
    Unknown

    AlogP:
    2.46

    Polar Surface Area:
    178.62

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  6. ALA4569717

    Name:
    3-(4-(4-chlorophenyl)-6-(furan-2-yl)pyridin-2-yl)p
    Show More

    Mol. Formula:
    C21H14ClNO2

    M.W.:
    347.80

    Type:
    Unknown

    AlogP:
    6.03

    Polar Surface Area:
    46.26

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  7. ALA4549448

    Name:
    3-(4-(4-chlorophenyl)-6-(thiophen-3-yl)pyridin-2-y
    Show More

    Mol. Formula:
    C21H14ClNOS

    M.W.:
    363.87

    Type:
    Unknown

    AlogP:
    6.50

    Polar Surface Area:
    33.12

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  8. ALA4575112

    Name:
    3-(4-(2-chlorophenyl)-6-(thiophen-3-yl)pyridin-2-y
    Show More

    Mol. Formula:
    C21H14ClNOS

    M.W.:
    363.87

    Type:
    Unknown

    AlogP:
    6.50

    Polar Surface Area:
    33.12

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  9. ALA4572793

    Name:
    3-ene-Withaphysangulidine E

    Mol. Formula:
    C28H36O7

    M.W.:
    484.59

    Type:
    Unknown

    AlogP:
    2.98

    Polar Surface Area:
    102.29

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  10. ALA4780758

    Name:
    5,5'-diallyl-3-(piperidin-1-yl(p-tolyl)methyl)biph
    Show More

    Mol. Formula:
    C31H35NO2

    M.W.:
    453.63

    Type:
    Unknown

    AlogP:
    7.11

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  11. ALA4780465

    Name:
    5,5'-diallyl-3-((4-bromophenyl)(piperidin-1-yl)met
    Show More

    Mol. Formula:
    C30H32BrNO2

    M.W.:
    518.50

    Type:
    Unknown

    AlogP:
    7.56

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  12. ALA4779961

    Name:
    3-(Piperidin-l-yl)-phenylmethyl-magnolol

    Mol. Formula:
    C30H33NO2

    M.W.:
    439.60

    Type:
    Unknown

    AlogP:
    6.80

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  13. ALA4778275

    Name:
    5,5'-diallyl-3-((3,4-dichlorophenyl)(piperidin-1-y
    Show More

    Mol. Formula:
    C30H31Cl2NO2

    M.W.:
    508.49

    Type:
    Unknown

    AlogP:
    8.10

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  14. ALA4777286

    Name:
    5,5'-diallyl-3-((4-methoxyphenyl)(piperidin-1-yl)m
    Show More

    Mol. Formula:
    C31H35NO3

    M.W.:
    469.63

    Type:
    Unknown

    AlogP:
    6.81

    Polar Surface Area:
    52.93

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  15. ALA4777270

    Name:
    5,5'-diallyl-3-((3-fluorophenyl)(piperidin-1-yl)me
    Show More

    Mol. Formula:
    C30H32FNO2

    M.W.:
    457.59

    Type:
    Unknown

    AlogP:
    6.94

    Polar Surface Area:
    43.70

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  16. ALA4776806

    Name:
    5,5'-diallyl-3-(piperidin-1-yl(2,3,4-trimethoxyphe
    Show More

    Mol. Formula:
    C33H39NO5

    M.W.:
    529.68

    Type:
    Unknown

    AlogP:
    6.82

    Polar Surface Area:
    71.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  17. ALA4590519

    Name:
    4-(4-(2-chlorophenyl)-6-(furan-2-yl)pyridin-2-yl)p
    Show More

    Mol. Formula:
    C21H14ClNO2

    M.W.:
    347.80

    Type:
    Unknown

    AlogP:
    6.03

    Polar Surface Area:
    46.26

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.49

    DETAILS
  18. ALA4584960

    Name:
    3-(4-(2-chlorophenyl)-6-phenylpyridin-2-yl)phenol

    Mol. Formula:
    C23H16ClNO

    M.W.:
    357.84

    Type:
    Unknown

    AlogP:
    6.44

    Polar Surface Area:
    33.12

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  19. ALA4582361

    Name:
    (1R,4aS,10aR)-methyl 6-hydroxy-7-isopropyl-1,4a-di
    Show More

    Mol. Formula:
    C21H30O3

    M.W.:
    330.47

    Type:
    Unknown

    AlogP:
    4.70

    Polar Surface Area:
    46.53

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  20. ALA4784898

    Name:
    5,5'-diallyl-3-(morpholino(p-tolyl)methyl)biphenyl
    Show More

    Mol. Formula:
    C30H33NO3

    M.W.:
    455.60

    Type:
    Unknown

    AlogP:
    5.95

    Polar Surface Area:
    52.93

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
Page
per page