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  1. ALA5267634

    Name:
    N-(4-propoxyphenyl)-5-[4-(p-tolylsulfanyl)-1-piperidyl]-[1,2,5]oxadiazolo[3Show More

    Mol. Formula:
    C25H28N6O2S

    M.W.:
    476.61

    Type:
    ---

    AlogP:
    5.61

    Polar Surface Area:
    89.20

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  2. ALA5282139

    Name:
    N-(benzofuran-5-yl)-5-[4-(4-chlorophenoxy)-1-piperidyl]-[1,2,5]oxadiazolo[3Show More

    Mol. Formula:
    C23H19ClN6O3

    M.W.:
    462.90

    Type:
    ---

    AlogP:
    5.20

    Polar Surface Area:
    102.34

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  3. ALA5281537

    Name:
    N-(4,4-difluorocyclohexyl)-4-[5-[1-(trifluoromethyl)cyclopropyl]-1H-pyrazolShow More

    Mol. Formula:
    C17H18F5N5

    M.W.:
    387.36

    Type:
    ---

    AlogP:
    4.45

    Polar Surface Area:
    66.49

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  4. ALA5276269

    Name:
    ethyl 4-[[5-(4-benzyl-1-piperidyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-yl]amiShow More

    Mol. Formula:
    C25H26N6O3

    M.W.:
    458.52

    Type:
    ---

    AlogP:
    4.39

    Polar Surface Area:
    106.27

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  5. ALA5275239

    Name:
    5-[4-(4-chlorophenoxy)-1-piperidyl]-N-(4-propoxyphenyl)-[1,2,5]oxadiazolo[3Show More

    Mol. Formula:
    C24H25ClN6O3

    M.W.:
    480.96

    Type:
    ---

    AlogP:
    5.25

    Polar Surface Area:
    98.43

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  6. ALA5274433

    Name:
    1-(3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-yl)-3-[4-[[4-Show More

    Mol. Formula:
    C41H27FN6O5S

    M.W.:
    734.77

    Type:
    ---

    AlogP:
    8.81

    Polar Surface Area:
    153.65

    HBA:
    9

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  7. ALA5273732

    Name:
    N-propyl-4-[[5-[4-(p-tolylsulfanyl)-1-piperidyl]-[1,2,5]oxadiazolo[3,4-b]pyShow More

    Mol. Formula:
    C26H29N7O2S

    M.W.:
    503.63

    Type:
    ---

    AlogP:
    4.97

    Polar Surface Area:
    109.07

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.34

    DETAILS
  8. ALA5287474

    Name:
    (Z)-3-[1-(2,2-dimethoxyethyl)-4-(4-fluorophenyl)-5-[2-[(3-methoxy-1-methyl-Show More

    Mol. Formula:
    C27H33FN4O5S

    M.W.:
    544.65

    Type:
    ---

    AlogP:
    5.29

    Polar Surface Area:
    107.73

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  9. ALA5287230

    Name:
    ethyl 4-[[5-[4-(4-chlorophenyl)sulfanyl-1-piperidyl]-[1,2,5]oxadiazolo[3,4-Show More

    Mol. Formula:
    C24H23ClN6O3S

    M.W.:
    511.01

    Type:
    ---

    AlogP:
    5.35

    Polar Surface Area:
    106.27

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  10. ALA5286313

    Name:
    ethyl 4-[[5-[4-(p-tolylsulfanyl)-1-piperidyl]-[1,2,5]oxadiazolo[3,4-b]pyrazShow More

    Mol. Formula:
    C25H26N6O3S

    M.W.:
    490.59

    Type:
    ---

    AlogP:
    5.00

    Polar Surface Area:
    106.27

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  11. ALA5284967

    Name:
    1-(3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-yl)-3-[4-[[4-Show More

    Mol. Formula:
    C42H29FN6O5S2

    M.W.:
    780.86

    Type:
    ---

    AlogP:
    9.53

    Polar Surface Area:
    153.65

    HBA:
    10

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.05

    DETAILS
  12. ALA5270704

    Name:
    N-cyclopropyl-4'-[3-(3,4-dihydroxybutyl)benzoyl]-2-methyl-[1,1'-biphenyl]-4Show More

    Mol. Formula:
    C28H29NO4

    M.W.:
    443.54

    Type:
    ---

    AlogP:
    4.07

    Polar Surface Area:
    86.63

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  13. ALA5269500

    Name:
    4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]pyrimidine

    Mol. Formula:
    C13H9ClN4

    M.W.:
    256.70

    Type:
    ---

    AlogP:
    3.19

    Polar Surface Area:
    54.46

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.77

    DETAILS
  14. ALA5271950

    Name:
    N1-[4-[4-(4-fluorophenyl)-1H-imidazol-5-yl]-2-pyridyl]benzene-1,4-diamine

    Mol. Formula:
    C20H16FN5

    M.W.:
    345.38

    Type:
    ---

    AlogP:
    4.60

    Polar Surface Area:
    79.62

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  15. ALA5271355

    Name:
    methyl 4-[[5-[4-(4-chlorophenoxy)-1-piperidyl]-[1,2,5]oxadiazolo[3,4-b]pyraShow More

    Mol. Formula:
    C23H21ClN6O4

    M.W.:
    480.91

    Type:
    ---

    AlogP:
    4.24

    Polar Surface Area:
    115.50

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  16. ALA5198646

    Name:
    1-(3-(tert-butyl)-1-(3-((4-methylpiperazin-1-yl)methyl)phenyl)-1H-pyrazol-5Show More

    Mol. Formula:
    C43H55N9O2

    M.W.:
    729.97

    Type:
    ---

    AlogP:
    8.03

    Polar Surface Area:
    104.85

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  17. ALA5198434

    Name:
    1-(3-(tert-butyl)-1'-(2-(dimethylamino)ethyl)-1'H-[1,3'-bipyrazol]-5-yl)-3-Show More

    Mol. Formula:
    C37H49N11O2

    M.W.:
    679.87

    Type:
    ---

    AlogP:
    6.13

    Polar Surface Area:
    122.67

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    3

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  18. ALA5198371

    Name:
    1-(3-(tert-butyl)-1'-(2-(ethyl(methyl)amino)ethyl)-1'H-[1,4'-bipyrazol]-5-yShow More

    Mol. Formula:
    C38H51N11O2

    M.W.:
    693.90

    Type:
    ---

    AlogP:
    6.52

    Polar Surface Area:
    122.67

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    3

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  19. ALA5198204

    Name:
    1-(3-(tert-butyl)-1-methyl-1H-pyrazol-5-yl)-3-((1S,4R)-4-((3-isopropyl-[1,2Show More

    Mol. Formula:
    C28H35N7O2

    M.W.:
    501.64

    Type:
    ---

    AlogP:
    5.66

    Polar Surface Area:
    98.37

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.37

    DETAILS
  20. ALA5197124

    Name:
    1-(3-(tert-butyl)-1-(3-(piperazin-1-ylmethyl)phenyl)-1H-pyrazol-5-yl)-3-((1Show More

    Mol. Formula:
    C40H50N10O2

    M.W.:
    702.91

    Type:
    ---

    AlogP:
    6.38

    Polar Surface Area:
    116.88

    HBA:
    10

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
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