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  1. ALA2071011

    Name:
    (R)-N-(4-(4-(trifluoromethoxy)phenyl)thiazol-2-yl)-1-(4-(trifluoromethoxy)pShow More

    Mol. Formula:
    C23H19F6N3O5S2

    M.W.:
    595.54

    Type:
    Small molecule

    AlogP:
    5.79

    Polar Surface Area:
    97.83

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  2. ALA2071010

    Name:
    (R)-1-(4-chlorophenylsulfonyl)-N-(5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-ylShow More

    Mol. Formula:
    C21H21ClN4O4S2

    M.W.:
    493.01

    Type:
    Small molecule

    AlogP:
    4.05

    Polar Surface Area:
    101.49

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  3. ALA2071009

    Name:
    (R)-N-(5-(benzofuran-5-yl)-1,3,4-thiadiazol-2-yl)-1-tosylpiperidine-2-carboShow More

    Mol. Formula:
    C23H22N4O4S2

    M.W.:
    482.59

    Type:
    Small molecule

    AlogP:
    4.44

    Polar Surface Area:
    105.40

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  4. ALA2071008

    Name:
    (R)-N-(5-(benzofuran-5-yl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C24H23N3O4S2

    M.W.:
    481.60

    Type:
    Small molecule

    AlogP:
    5.05

    Polar Surface Area:
    92.51

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  5. ALA2071007

    Name:
    (R)-N-(5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl)-1-tosylpiperidine-2-carboShow More

    Mol. Formula:
    C22H24N4O4S2

    M.W.:
    472.59

    Type:
    Small molecule

    AlogP:
    3.70

    Polar Surface Area:
    101.49

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  6. ALA2071006

    Name:
    (R)-N-(5-(4-methoxyphenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C23H25N3O4S2

    M.W.:
    471.60

    Type:
    Small molecule

    AlogP:
    4.31

    Polar Surface Area:
    88.60

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  7. ALA2071005

    Name:
    (R)-1-tosyl-N-(4-(4-(trifluoromethoxy)phenyl)thiazol-2-yl)piperidine-2-carbShow More

    Mol. Formula:
    C23H22F3N3O4S2

    M.W.:
    525.57

    Type:
    Small molecule

    AlogP:
    5.20

    Polar Surface Area:
    88.60

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  8. ALA2071004

    Name:
    (R)-N-(4-(benzofuran-5-yl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C24H23N3O4S2

    M.W.:
    481.60

    Type:
    Small molecule

    AlogP:
    5.05

    Polar Surface Area:
    92.51

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  9. ALA2071003

    Name:
    (R)-N-(benzo[d]thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C20H21N3O3S2

    M.W.:
    415.54

    Type:
    Small molecule

    AlogP:
    3.79

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.70

    DETAILS
  10. ALA2071002

    Name:
    (R)-N-(thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C16H19N3O3S2

    M.W.:
    365.48

    Type:
    Small molecule

    AlogP:
    2.63

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.90

    DETAILS
  11. ALA2071001

    Name:
    (R)-N-(4-(4-chlorophenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C22H22ClN3O3S2

    M.W.:
    476.02

    Type:
    Small molecule

    AlogP:
    4.95

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
  12. ALA2071000

    Name:
    (R)-N-(4-(4-nitrophenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C22H22N4O5S2

    M.W.:
    486.58

    Type:
    Small molecule

    AlogP:
    4.21

    Polar Surface Area:
    122.51

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  13. ALA2070999

    Name:
    (R)-N-(4-p-tolylthiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C23H25N3O3S2

    M.W.:
    455.61

    Type:
    Small molecule

    AlogP:
    4.61

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  14. ALA2070998

    Name:
    (R)-N-(4-(4-fluorophenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C22H22FN3O3S2

    M.W.:
    459.57

    Type:
    Small molecule

    AlogP:
    4.44

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  15. ALA2070997

    Name:
    (R)-N-(4-phenylthiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C22H23N3O3S2

    M.W.:
    441.58

    Type:
    Small molecule

    AlogP:
    4.30

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
  16. ALA2070996

    Name:
    (R)-N-(4-(4-isopropylphenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide

    Mol. Formula:
    C25H29N3O3S2

    M.W.:
    483.66

    Type:
    Small molecule

    AlogP:
    5.42

    Polar Surface Area:
    79.37

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  17. ALA2070995

    Name:
    (R)-N-(4-(4-methoxyphenyl)thiazol-2-yl)-2-(4-methylphenylsulfonamido)propanShow More

    Mol. Formula:
    C20H21N3O4S2

    M.W.:
    431.54

    Type:
    Small molecule

    AlogP:
    3.43

    Polar Surface Area:
    97.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  18. ALA2070994

    Name:
    (R)-N-(4-(4-methoxyphenyl)thiazol-2-yl)-3-methyl-2-(4-methylphenylsulfonamiShow More

    Mol. Formula:
    C22H25N3O4S2

    M.W.:
    459.59

    Type:
    Small molecule

    AlogP:
    4.07

    Polar Surface Area:
    97.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  19. ALA2070993

    Name:
    (R)-N-(4-(4-methoxyphenyl)thiazol-2-yl)-3,3-dimethyl-2-(4-methylphenylsulfoShow More

    Mol. Formula:
    C23H27N3O4S2

    M.W.:
    473.62

    Type:
    Small molecule

    AlogP:
    4.46

    Polar Surface Area:
    97.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  20. ALA2070992

    Name:
    N-(4-(4-methoxyphenyl)thiazol-2-yl)-3-(4-methylphenylsulfonamido)propanamidShow More

    Mol. Formula:
    C20H21N3O4S2

    M.W.:
    431.54

    Type:
    Small molecule

    AlogP:
    3.43

    Polar Surface Area:
    97.39

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.57

    DETAILS
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