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

8 Items

Set Ascending Direction
Select all
  1. ALA5281049

    Name:
    (1R,2R,3S,4R,5S)-4-(6-((5-chlorothiophen-2-yl)ethynyl)-4-(methylamino)-1H-iShow More

    Mol. Formula:
    C21H20ClN5O3S

    M.W.:
    457.94

    Type:
    ---

    AlogP:
    1.62

    Polar Surface Area:
    112.30

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  2. ALA5088750

    Name:
    Methyl (E)-3-(3-methyl-5-(2-(nicotinamido)-5-(pyridin-4-yl)thiazol-4-yl)pheShow More

    Mol. Formula:
    C25H20N4O3S

    M.W.:
    456.53

    Type:
    Unknown

    AlogP:
    5.01

    Polar Surface Area:
    94.07

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  3. ALA5086258

    Name:
    N-(4-(3-Iodo-5-methylphenyl)-5-(pyridin-4-yl)thiazol-2-yl)nicotinamide

    Mol. Formula:
    C21H15IN4OS

    M.W.:
    498.35

    Type:
    Unknown

    AlogP:
    5.43

    Polar Surface Area:
    67.77

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  4. ALA5081520

    Name:
    N-(4-(3-Bromo-5-methylphenyl)-5-(pyridin-4-yl)thiazol-2-yl)nicotinamide

    Mol. Formula:
    C21H15BrN4OS

    M.W.:
    451.35

    Type:
    Unknown

    AlogP:
    5.59

    Polar Surface Area:
    67.77

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  5. ALA4279740

    Name:
    triethylamine hemi(2-((1E,3E,5E)-5-(3-(6-(2-(2-(4-(3-(5-amino-2-(furan-2-ylShow More

    Mol. Formula:
    C71H99N13O16S4

    M.W.:
    1518.92

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA2402025

    Name:
    4-(2-(9-((1S,2R,3S,4R,5S)-3,4-Dihydroxy-5-(methylcarbamoyl)bicyclo[3.1.0]heShow More

    Mol. Formula:
    C29H28N6O6S

    M.W.:
    588.65

    Type:
    Small molecule

    AlogP:
    1.16

    Polar Surface Area:
    179.56

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  7. ALA2402024

    Name:
    (1S,2R,3S,4R,5S)-2,3-Dihydroxy-N-methyl-4-(6-(phenethylamino)-2-(phenylethyShow More

    Mol. Formula:
    C29H28N6O3

    M.W.:
    508.58

    Type:
    Small molecule

    AlogP:
    1.91

    Polar Surface Area:
    125.19

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  8. ALA2402023

    Name:
    4-(2-(9-((1S,2R,3S,4R,5R)-3,4-Dihydroxybicyclo[3.1.0]hexan-2-yl)-2-(phenyleShow More

    Mol. Formula:
    C27H25N5O5S

    M.W.:
    531.59

    Type:
    Small molecule

    AlogP:
    2.04

    Polar Surface Area:
    150.46

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
per page