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  1. ALA5267606

    Name:
    methyl 3-(3-methoxy-4-(4-((1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indol-3-yl)aShow More

    Mol. Formula:
    C33H33N3O5

    M.W.:
    551.64

    Type:
    ---

    AlogP:
    6.86

    Polar Surface Area:
    94.70

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  2. ALA5267454

    Name:
    Tert-Butyl 1-(4-(Hydroxycarbamoyl)benzyl)-2-(pyridin-3-yl)spiro-[indoline-3Show More

    Mol. Formula:
    C30H34N4O4

    M.W.:
    514.63

    Type:
    ---

    AlogP:
    5.23

    Polar Surface Area:
    95.00

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  3. ALA5267435

    Name:
    (+/-)5-((3,3-Dimethyl-2-(pyridin-3-yl)indolin-1-yl)methyl)-N-hydroxythiopheShow More

    Mol. Formula:
    C21H21N3O2S

    M.W.:
    379.49

    Type:
    ---

    AlogP:
    4.30

    Polar Surface Area:
    65.46

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  4. ALA5266668

    Name:
    N-(5-(2-mercapto-2-methylpropanamido)pentyl)-5-methyl-3-phenylisoxazole-4-cShow More

    Mol. Formula:
    C20H27N3O3S

    M.W.:
    389.52

    Type:
    ---

    AlogP:
    3.37

    Polar Surface Area:
    84.23

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  5. ALA5266615

    Name:
    N'-Butyl-4-fluorobenzohydrazide

    Mol. Formula:
    C11H15FN2O

    M.W.:
    210.25

    Type:
    ---

    AlogP:
    1.86

    Polar Surface Area:
    41.13

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.58

    DETAILS
  6. ALA5266442

    Name:
    7-((4-Fluoro-3-methylbenzyl)amino)-N-hydroxyheptanamide

    Mol. Formula:
    C15H23FN2O2

    M.W.:
    282.36

    Type:
    ---

    AlogP:
    2.68

    Polar Surface Area:
    61.36

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  7. ALA5266137

    Name:
    (R)-4-((3-benzyl-4-(3-chlorobenzyl)-2,5-dioxopiperazin-1-yl)methyl)-N-hydroShow More

    Mol. Formula:
    C26H24ClN3O4

    M.W.:
    477.95

    Type:
    ---

    AlogP:
    3.44

    Polar Surface Area:
    89.95

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  8. ALA5266056

    Name:
    N-(2-aminophenyl)-4-(((4-phenylthiazol-2-yl)amino)methyl)benzamide

    Mol. Formula:
    C23H20N4OS

    M.W.:
    400.51

    Type:
    ---

    AlogP:
    5.26

    Polar Surface Area:
    80.04

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  9. ALA5266011

    Name:
    methyl 3-(3-methoxy-4-(2-((1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indol-3-yl)aShow More

    Mol. Formula:
    C31H29N3O5

    M.W.:
    523.59

    Type:
    ---

    AlogP:
    6.08

    Polar Surface Area:
    94.70

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  10. ALA5265931

    Name:
    N-hydroxy-4-(3-(3-hydroxy-4-(thiophen-2-yloxy)phenyl)propanamido)benzamide

    Mol. Formula:
    C20H18N2O5S

    M.W.:
    398.44

    Type:
    ---

    AlogP:
    3.94

    Polar Surface Area:
    107.89

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  11. ALA5265776

    Name:
    Trans-2-mercapto-N-(7-(5-methyl-3-phenylisoxazol-4-yl)hept-6-en-1-yl)acetamShow More

    Mol. Formula:
    C19H24N2O2S

    M.W.:
    344.48

    Type:
    ---

    AlogP:
    4.27

    Polar Surface Area:
    55.13

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  12. ALA5221097

    Name:
    (S)-6-ethyl-N-((S)-1-(5-(6-methoxy-2-methyl-2H-indazol-5-yl)-1H-imidazol-2-Show More

    Mol. Formula:
    C31H44N6O3

    M.W.:
    548.73

    Type:
    ---

    AlogP:
    5.18

    Polar Surface Area:
    105.14

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  13. ALA5221068

    Name:
    (S)-N-[(1S)-1-[5-(3a,7a-dihydro-1,3-benzoxazol-6-yl)-1H-imidazol-2-yl]-7-oxShow More

    Mol. Formula:
    C28H39N5O3

    M.W.:
    493.65

    Type:
    ---

    AlogP:
    3.98

    Polar Surface Area:
    99.68

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  14. ALA5220969

    Name:
    (S)-6-ethyl-N-((S)-1-(5-(7-methoxy-1-methyl-2-oxo-1,2-dihydroquinolin-6-yl)Show More

    Mol. Formula:
    C33H45N5O4

    M.W.:
    575.75

    Type:
    ---

    AlogP:
    5.15

    Polar Surface Area:
    109.32

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  15. ALA5220945

    Name:
    N1-(4-((5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazol-6-yl)Show More

    Mol. Formula:
    C25H25F2N7O3

    M.W.:
    509.52

    Type:
    ---

    AlogP:
    3.92

    Polar Surface Area:
    134.06

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  16. ALA5220926

    Name:
    (S)-6-ethyl-N-((S)-1-(5-(7-methoxy-2-methylquinolin-6-yl)-1H-imidazol-2-yl)Show More

    Mol. Formula:
    C33H45N5O3

    M.W.:
    559.76

    Type:
    ---

    AlogP:
    6.15

    Polar Surface Area:
    100.21

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  17. ALA5220844

    Name:
    (S)-6-methyl-N-((S)-7-oxo-1-(5-(2-oxo-1,2-dihydroquinolin-3-yl)-1H-imidazolShow More

    Mol. Formula:
    C30H39N5O3

    M.W.:
    517.67

    Type:
    ---

    AlogP:
    4.74

    Polar Surface Area:
    110.95

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  18. ALA5220815

    Name:
    (S)-N-[(1S)-1-[5-(3a,7a-dihydro-1,3-benzothiazol-6-yl)-1H-imidazol-2-yl]-7-Show More

    Mol. Formula:
    C28H39N5O2S

    M.W.:
    509.72

    Type:
    ---

    AlogP:
    4.69

    Polar Surface Area:
    90.45

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.42

    DETAILS
  19. ALA5220720

    Name:
    (S)-N-((S)-1-(5-(2-(1H-pyrazol-1-yl)quinolin-6-yl)-1H-imidazol-2-yl)-7-oxonShow More

    Mol. Formula:
    C33H41N7O2

    M.W.:
    567.74

    Type:
    ---

    AlogP:
    5.63

    Polar Surface Area:
    108.80

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  20. ALA5220715

    Name:
    (S)-6-ethyl-N-((S)-1-(5-(2-methoxy-1,8-naphthyridin-3-yl)oxazol-2-yl)-7-oxoShow More

    Mol. Formula:
    C31H41N5O4

    M.W.:
    547.70

    Type:
    ---

    AlogP:
    5.50

    Polar Surface Area:
    110.45

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
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