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  1. ALA4514705

    Name:
    (E)-3-(3-(4-(((3,4-difluorophenyl)amino)methyl)-1H
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    Mol. Formula:
    C23H23F2N5O3

    M.W.:
    455.46

    Type:
    Unknown

    AlogP:
    3.48

    Polar Surface Area:
    92.51

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  2. ALA4514602

    Name:
    4-(4-(Cyclohexyl(isobutyl)amino)-3-(3-(m-tolyl)ure
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    Mol. Formula:
    C31H39N3O4

    M.W.:
    517.67

    Type:
    Unknown

    AlogP:
    8.01

    Polar Surface Area:
    94.81

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  3. ALA4514196

    Name:
    methyl rac-N-[2-({4-[N-(3-bromo-4-fluorophenyl)-N'
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    Mol. Formula:
    C13H17BrFN6O4P

    M.W.:
    451.19

    Type:
    Unknown

    AlogP:
    2.69

    Polar Surface Area:
    133.90

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  4. ALA4514159

    Name:
    Isopropyl N-[2-({4-[N-(3-bromo-4-fluorophenyl)-N'-
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    Mol. Formula:
    C15H21BrFN6O4P

    M.W.:
    479.25

    Type:
    Unknown

    AlogP:
    3.47

    Polar Surface Area:
    133.90

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  5. ALA4513476

    Name:
    Rac-tert-Butyl 4-(1H-Indole-7-carboxamido)spiro[ch
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    Mol. Formula:
    C27H31N3O4

    M.W.:
    461.56

    Type:
    Unknown

    AlogP:
    5.19

    Polar Surface Area:
    83.66

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  6. ALA4513280

    Name:
    (2R,Z)-N-(2-Bromophenyl)-2-((4-(hydroxyimino)-1-ox
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    Mol. Formula:
    C25H20BrN3O3

    M.W.:
    490.36

    Type:
    Unknown

    AlogP:
    4.55

    Polar Surface Area:
    90.79

    HBA:
    5

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  7. ALA4483789

    Name:
    Ethyl (S)-6-Bromo-4-(2-(2,2,2-trifluoroacetamido)b
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    Mol. Formula:
    C25H25BrF3N3O5

    M.W.:
    584.39

    Type:
    Unknown

    AlogP:
    5.19

    Polar Surface Area:
    96.97

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  8. ALA4483096

    Name:
    (Z)-4-amino-N'-hydroxy-N-(1,2,3,4-tetrahydronaphth
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    Mol. Formula:
    C13H15N5O2

    M.W.:
    273.30

    Type:
    Unknown

    AlogP:
    1.45

    Polar Surface Area:
    109.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  9. ALA4483087

    Name:
    N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-[2-(sulfam
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    Mol. Formula:
    C11H12BrFN6O5S

    M.W.:
    439.22

    Type:
    Unknown

    AlogP:
    0.39

    Polar Surface Area:
    164.96

    HBA:
    8

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  10. ALA4476409

    Name:
    5-(2-Phenethoxyphenyl)-1H-imidazole

    Mol. Formula:
    C17H16N2O

    M.W.:
    264.33

    Type:
    Unknown

    AlogP:
    3.70

    Polar Surface Area:
    37.91

    HBA:
    2

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  11. ALA4476353

    Name:
    Rac-Ethyl 4-(1H-Indazole-7-carboxamido)spiro[chrom
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    Mol. Formula:
    C24H26N4O4

    M.W.:
    434.50

    Type:
    Unknown

    AlogP:
    3.81

    Polar Surface Area:
    96.55

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  12. ALA4476312

    Name:
    (trans)-4-(2-(6-Fluoro-5H-imidazo[5,1-a]isoindol-5
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    Mol. Formula:
    C18H21FN2O2

    M.W.:
    316.38

    Type:
    Unknown

    AlogP:
    2.89

    Polar Surface Area:
    58.28

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.92

    DETAILS
  13. ALA4476018

    Name:
    4-(((6-Bromo-1H-indazol-4-yl)amino)methyl)benzene-
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    Mol. Formula:
    C14H12BrN3O2

    M.W.:
    334.17

    Type:
    Unknown

    AlogP:
    3.35

    Polar Surface Area:
    81.17

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  14. ALA4475838

    Name:
    Ethyl (S)-6-Cyano-4-(1H-indazole-7-carboxamido)spi
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    Mol. Formula:
    C25H25N5O4

    M.W.:
    459.51

    Type:
    Unknown

    AlogP:
    3.68

    Polar Surface Area:
    120.34

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.62

    DETAILS
  15. ALA4475809

    Name:
    (S,Z)-4-amino-N-(4-fluorobicyclo[4.2.0]octa-1(6),2
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    Mol. Formula:
    C11H10FN5O2

    M.W.:
    263.23

    Type:
    Unknown

    AlogP:
    0.81

    Polar Surface Area:
    109.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  16. ALA4475499

    Name:
    N-[2-[[4-[N-[3-(difluoromethyl)phenyl]-N'-hydroxyc
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    Mol. Formula:
    C14H16F2N6O5S2

    M.W.:
    450.45

    Type:
    Unknown

    AlogP:
    0.75

    Polar Surface Area:
    172.80

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  17. ALA4474728

    Name:
    (E)-3-(4-morpholino-3-(4-((4-(trifluoromethyl)phen
    Show More

    Mol. Formula:
    C24H23F3N4O4

    M.W.:
    488.47

    Type:
    Unknown

    AlogP:
    4.19

    Polar Surface Area:
    89.71

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  18. ALA4474478

    Name:
    N-(2-(5-Phenyl-1H-imidazol-1-yl)ethyl)acetamide

    Mol. Formula:
    C13H15N3O

    M.W.:
    229.28

    Type:
    Unknown

    AlogP:
    1.69

    Polar Surface Area:
    46.92

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  19. ALA4474299

    Name:
    (R,Z)-4-amino-N-(2,3-dihydro-1H-inden-1-yl)-N'-hyd
    Show More

    Mol. Formula:
    C12H13N5O2

    M.W.:
    259.27

    Type:
    Unknown

    AlogP:
    1.06

    Polar Surface Area:
    109.56

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
  20. ALA4540285

    Name:
    (2R)-2-((1,4-Dioxo-1,4-dihydronaphthalen-2-yl)amin
    Show More

    Mol. Formula:
    C26H22N2O3

    M.W.:
    410.47

    Type:
    Unknown

    AlogP:
    4.10

    Polar Surface Area:
    75.27

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.64

    DETAILS
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