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  1. ALA5272173

    Name:
    4-(5-cyano-1H-pyrrolo[2,3-b]pyridin-1-yl)-N-((1r,4r)-4-((2-(2-(2-((2-(2,6-dShow More

    Mol. Formula:
    C44H47N9O9

    M.W.:
    845.91

    Type:
    ---

    AlogP:
    2.74

    Polar Surface Area:
    242.95

    HBA:
    13

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  2. ALA5275511

    Name:
    4-((3-(4-(3-((4-(4-acryloylpiperazin-1-yl)-6-chloro-8-fluoro-7-(3-hydroxynaShow More

    Mol. Formula:
    C48H50ClFN10O6

    M.W.:
    917.44

    Type:
    ---

    AlogP:
    5.11

    Polar Surface Area:
    183.65

    HBA:
    13

    HBD:
    4

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  3. ALA4869528

    Name:
    (E)-(2-(2-(4-(3,4-dichlorophenyl)-5-(2-(2-(2-(2,6-dioxopiperidin-3-yl)-1,3-Show More

    Mol. Formula:
    C35H35Cl2N7O9S

    M.W.:
    800.68

    Type:
    Unknown

    AlogP:
    4.17

    Polar Surface Area:
    214.56

    HBA:
    14

    HBD:
    4

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.05

    DETAILS
  4. ALA4860669

    Name:
    (E)-2-(2-(4-(biphenyl-4-yl)thiazol-2-yl)hydrazono)-N-(4-(2-(2,6-dioxopiperiShow More

    Mol. Formula:
    C35H33N7O5S

    M.W.:
    663.76

    Type:
    Unknown

    AlogP:
    4.67

    Polar Surface Area:
    161.96

    HBA:
    10

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  5. ALA4855690

    Name:
    (Z)-2-(2-(4-(biphenyl-4-yl)thiazol-2-yl)hydrazono)-N-(4-(2-(2,6-dioxopiperiShow More

    Mol. Formula:
    C40H34N8O7S

    M.W.:
    770.83

    Type:
    Unknown

    AlogP:
    5.61

    Polar Surface Area:
    205.10

    HBA:
    12

    HBD:
    4

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.04

    DETAILS
  6. 1-Methylpyrimidine-2,4(1H,3H)-dione

    Name:
    1-Methyluracil

    Mol. Formula:
    C5H6N2O2

    M.W.:
    126.11

    Type:
    Unknown

    AlogP:
    -0.93

    Polar Surface Area:
    54.86

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.49

    DETAILS
  7. ALA4785425

    Name:
    1-Benzylidene-aminohydantoin

    Mol. Formula:
    C10H9N3O2

    M.W.:
    203.20

    Type:
    Unknown

    AlogP:
    0.57

    Polar Surface Area:
    61.77

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  8. ALA4759876

    Name:
    1-Aminouracil

    Mol. Formula:
    C4H5N3O2

    M.W.:
    127.10

    Type:
    Unknown

    AlogP:
    -1.75

    Polar Surface Area:
    80.88

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  9. ALA4758543

    Name:
    1-(2-nitrobenzylideneamino)imidazolidine-2,4-dione

    Mol. Formula:
    C10H8N4O4

    M.W.:
    248.20

    Type:
    Unknown

    AlogP:
    0.48

    Polar Surface Area:
    104.91

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  10. 1-Methylhydantoin

    Name:
    1-Methylhydantoin

    Mol. Formula:
    C4H6N2O2

    M.W.:
    114.10

    Type:
    Unknown

    AlogP:
    -0.83

    Polar Surface Area:
    49.41

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    Y

    QED Weighted:
    0.42

    DETAILS
  11. ALA4756680

    Name:
    Aminohydantoin

    Mol. Formula:
    C3H5N3O2

    M.W.:
    115.09

    Type:
    Unknown

    AlogP:
    -1.59

    Polar Surface Area:
    75.43

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    ---

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  12. ALA4583085

    Name:
    3-(4-(4-(6-(4-(6-(4-chlorophenyl)-1-methylspiro[benzo[f][1,2,4]triazolo[4,3Show More

    Mol. Formula:
    C43H47ClN10O2

    M.W.:
    771.37

    Type:
    Unknown

    AlogP:
    6.53

    Polar Surface Area:
    125.57

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    3

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  13. ALA4575643

    Name:
    3-((3-methoxyphenyl)(methyl)amino)piperidine-2,6-dione

    Mol. Formula:
    C13H16N2O3

    M.W.:
    248.28

    Type:
    Unknown

    AlogP:
    0.94

    Polar Surface Area:
    58.64

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.81

    DETAILS
  14. ALA4572078

    Name:
    4'-(2,6-dioxopiperidin-3-yloxy)biphenyl-4-carbonitrile

    Mol. Formula:
    C18H14N2O3

    M.W.:
    306.32

    Type:
    Unknown

    AlogP:
    2.41

    Polar Surface Area:
    79.19

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  15. ALA4552409

    Name:
    tert-butyl 4-(4-(2,6-dioxopiperidin-3-yloxy)phenyl)piperazine-1-carboxylate

    Mol. Formula:
    C20H27N3O5

    M.W.:
    389.45

    Type:
    Unknown

    AlogP:
    1.93

    Polar Surface Area:
    88.18

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  16. ALA4470968

    Name:
    2-((6S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[Show More

    Mol. Formula:
    C42H52ClN9O3S

    M.W.:
    798.46

    Type:
    Unknown

    AlogP:
    6.69

    Polar Surface Area:
    136.85

    HBA:
    11

    HBD:
    3

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  17. ALA4466169

    Name:
    3-(2-morpholinophenylamino)piperidine-2,6-dione

    Mol. Formula:
    C15H19N3O3

    M.W.:
    289.34

    Type:
    Unknown

    AlogP:
    0.74

    Polar Surface Area:
    70.67

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  18. ALA4459677

    Name:
    3-(4-(4-methylpiperazin-1-yl)phenylamino)piperidine-2,6-dione

    Mol. Formula:
    C16H22N4O2

    M.W.:
    302.38

    Type:
    Unknown

    AlogP:
    0.66

    Polar Surface Area:
    64.68

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  19. ALA4453217

    Name:
    3-(4-(3-oxobutyl)phenoxy)piperidine-2,6-dione

    Mol. Formula:
    C15H17NO4

    M.W.:
    275.30

    Type:
    Unknown

    AlogP:
    1.39

    Polar Surface Area:
    72.47

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.82

    DETAILS
  20. TL 13-22

    Name:
    N-(2-(2-(2-(4-(4-((5-Chloro-4-((2-(isopropylsulfonyl)phenyl)-amino)pyrimidiShow More

    Mol. Formula:
    C45H55ClN10O9S

    M.W.:
    947.52

    Type:
    Small molecule

    AlogP:
    4.07

    Polar Surface Area:
    225.76

    HBA:
    16

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    21

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
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