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  1. ALA5270214

    Name:
    N-(2-chlorophenyl)-2-((3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoliShow More

    Mol. Formula:
    C27H28ClN3O2S

    M.W.:
    494.06

    Type:
    ---

    AlogP:
    6.07

    Polar Surface Area:
    63.99

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  2. ALA5270085

    Name:
    3-ethyl-2-(methylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-Show More

    Mol. Formula:
    C20H24N2OS

    M.W.:
    340.49

    Type:
    ---

    AlogP:
    4.41

    Polar Surface Area:
    34.89

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.60

    DETAILS
  3. ALA5267876

    Name:
    3-ethyl-2-thioxo-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-Show More

    Mol. Formula:
    C19H22N2OS

    M.W.:
    326.47

    Type:
    ---

    AlogP:
    4.35

    Polar Surface Area:
    37.79

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  4. ALA5284443

    Name:
    2-((3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]Show More

    Mol. Formula:
    C27H29N3O2S

    M.W.:
    459.62

    Type:
    ---

    AlogP:
    5.42

    Polar Surface Area:
    63.99

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  5. ALA5290836

    Name:
    2-((4-chlorobenzyl)thio)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexShow More

    Mol. Formula:
    C26H27ClN2OS

    M.W.:
    451.04

    Type:
    ---

    AlogP:
    6.63

    Polar Surface Area:
    34.89

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  6. ALA5289978

    Name:
    2-((3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]Show More

    Mol. Formula:
    C27H37N3O2S

    M.W.:
    467.68

    Type:
    ---

    AlogP:
    5.43

    Polar Surface Area:
    55.20

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.38

    DETAILS
  7. ALA5277454

    Name:
    2-((3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]Show More

    Mol. Formula:
    C28H28F3N3O2S

    M.W.:
    527.61

    Type:
    ---

    AlogP:
    6.44

    Polar Surface Area:
    63.99

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  8. ALA5208308

    Name:
    3-(3-fluoro-2-methylbenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1Show More

    Mol. Formula:
    C20H20FNO3

    M.W.:
    341.38

    Type:
    ---

    AlogP:
    3.16

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  9. ALA5208071

    Name:
    (3S)-1-(1-(3,4-Difluorobenzyl)-3-oxo-1,3-dihydroisobenzofuran-5-yl)pyrrolidShow More

    Mol. Formula:
    C20H18F2N2O3

    M.W.:
    372.37

    Type:
    ---

    AlogP:
    2.73

    Polar Surface Area:
    72.63

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  10. ALA5206291

    Name:
    6-((R)-3-Hydroxypyrrolidin-1-yl)-3-(2-methyl-4-(trifluoromethoxy)benzyl)isoShow More

    Mol. Formula:
    C21H20F3NO4

    M.W.:
    407.39

    Type:
    ---

    AlogP:
    3.92

    Polar Surface Area:
    59.00

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  11. ALA5200168

    Name:
    3-(2,5-Difluorobenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1(3H)-Show More

    Mol. Formula:
    C19H17F2NO3

    M.W.:
    345.35

    Type:
    ---

    AlogP:
    2.99

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  12. ALA5197093

    Name:
    3-(4-Fluorobenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1(3H)-one

    Mol. Formula:
    C19H18FNO3

    M.W.:
    327.36

    Type:
    ---

    AlogP:
    2.85

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  13. ALA5196664

    Name:
    3-(5-Fluoro-2-methylbenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1Show More

    Mol. Formula:
    C20H20FNO3

    M.W.:
    341.38

    Type:
    ---

    AlogP:
    3.16

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  14. ALA5196515

    Name:
    6-((S)-3-Hydroxypyrrolidin-1-yl)-3-(4-(trifluoromethyl)benzyl)isobenzofuranShow More

    Mol. Formula:
    C20H18F3NO3

    M.W.:
    377.36

    Type:
    ---

    AlogP:
    3.73

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
  15. ALA5195686

    Name:
    3-(4-Chlorobenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1(3H)-one

    Mol. Formula:
    C19H18ClNO3

    M.W.:
    343.81

    Type:
    ---

    AlogP:
    3.37

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.87

    DETAILS
  16. ALA5188477

    Name:
    3-(3-Fluorobenzyl)-6-((R)-3-hydroxypyrrolidin-1-yl)isobenzofuran-1(3H)-one

    Mol. Formula:
    C19H18FNO3

    M.W.:
    327.36

    Type:
    ---

    AlogP:
    2.85

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.88

    DETAILS
  17. ALA5187602

    Name:
    3-(3,4-difluorobenzyl)-6-((R)-3-methoxypyrrolidin-1-yl)isobenzofuran-1(3H)-Show More

    Mol. Formula:
    C20H19F2NO3

    M.W.:
    359.37

    Type:
    ---

    AlogP:
    3.64

    Polar Surface Area:
    38.77

    HBA:
    4

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.78

    DETAILS
  18. ALA5186404

    Name:
    (3R)-1-(1-(3,4-difluorobenzyl)-3-oxo-1,3-dihydroisobenzofuran-5-yl)pyrrolidShow More

    Mol. Formula:
    C20H18F2N2O3

    M.W.:
    372.37

    Type:
    ---

    AlogP:
    2.73

    Polar Surface Area:
    72.63

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.84

    DETAILS
  19. ALA5183935

    Name:
    (3S)-1-(3-oxo-1-(4-(trifluoromethyl)benzyl)-1,3-dihydroisobenzofuran-5-yl)pShow More

    Mol. Formula:
    C21H19F3N2O3

    M.W.:
    404.39

    Type:
    ---

    AlogP:
    3.47

    Polar Surface Area:
    72.63

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  20. ALA5182153

    Name:
    6-((R)-3-Hydroxypyrrolidin-1-yl)-3-(4-(trifluoromethyl)benzyl)isobenzofuranShow More

    Mol. Formula:
    C20H18F3NO3

    M.W.:
    377.36

    Type:
    ---

    AlogP:
    3.73

    Polar Surface Area:
    49.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.83

    DETAILS
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