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  1. ALA5272197

    Name:
    5-(3-hydroxypropoxy)-2-methyl-7-(naphthalen-2-ylmethoxy)-4H-chromen-4-one

    Mol. Formula:
    C24H22O5

    M.W.:
    390.44

    Type:
    ---

    AlogP:
    4.59

    Polar Surface Area:
    68.90

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  2. ALA5281902

    Name:
    5-((2-(hydroxymethyl)benzyl)oxy)-2-isopropyl-7-(naphthalen-2-ylmethoxy)-4H-Show More

    Mol. Formula:
    C31H28O5

    M.W.:
    480.56

    Type:
    ---

    AlogP:
    6.72

    Polar Surface Area:
    68.90

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.27

    DETAILS
  3. ALA5284031

    Name:
    2-((6-Bromo-2-hydroxynaphthalen-1-yl)methyl)-3-(4-bromophenyl)-N-methyl-3-oShow More

    Mol. Formula:
    C21H17Br2NO3

    M.W.:
    491.18

    Type:
    ---

    AlogP:
    4.86

    Polar Surface Area:
    66.40

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  4. ALA5283778

    Name:
    6-(5-hydroxypentyl)-1-isobutyl-3-methyl-7-((naphthalen-2-yloxy)methyl)pteriShow More

    Mol. Formula:
    C27H32N4O4

    M.W.:
    476.58

    Type:
    ---

    AlogP:
    3.58

    Polar Surface Area:
    99.24

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  5. ALA5219900

    Name:
    (2R)-2-amino-N-[5-[[4-[[5-(3-hydroxypropylsulfanyl)-1-isobutyl-3-methyl-4-oShow More

    Mol. Formula:
    C34H48N8O4S

    M.W.:
    664.88

    Type:
    ---

    AlogP:
    3.30

    Polar Surface Area:
    183.18

    HBA:
    11

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    19

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  6. ALA5266330

    Name:
    5-(3-hydroxypropoxy)-2-isopropyl-7-(naphthalen-2-ylmethoxy)-4H-chromen-4-onShow More

    Mol. Formula:
    C26H26O5

    M.W.:
    418.49

    Type:
    ---

    AlogP:
    5.41

    Polar Surface Area:
    68.90

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.39

    DETAILS
  7. ALA5220748

    Name:
    (2R)-2-amino-N-[5-[[4-[[5-(3-hydroxypropylsulfanyl)-1-isobutyl-3-methyl-4-oShow More

    Mol. Formula:
    C34H48N8O4S

    M.W.:
    664.88

    Type:
    ---

    AlogP:
    3.30

    Polar Surface Area:
    183.18

    HBA:
    11

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    19

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  8. ALA5218732

    Name:
    (2R)-2-amino-N-[5-[4-[[5-(3-hydroxypropylsulfanyl)-1-isobutyl-3-methyl-4-oxShow More

    Mol. Formula:
    C35H44N6O4S

    M.W.:
    644.84

    Type:
    ---

    AlogP:
    3.45

    Polar Surface Area:
    158.26

    HBA:
    9

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  9. ALA4790354

    Name:
    (5-Chloro-2-methoxy-4-(((2-methyl-[1,1'-biphenyl]-3-yl)methyl)-amino)benzylShow More

    Mol. Formula:
    C25H27ClN2O4

    M.W.:
    454.95

    Type:
    Unknown

    AlogP:
    4.47

    Polar Surface Area:
    90.82

    HBA:
    5

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.36

    DETAILS
  10. ALA4783983

    Name:
    (2-((5-Cyanopyridin-3-yl)methoxy)-4-(((2-methyl-[1,1'-biphenyl]-3-yl)methylShow More

    Mol. Formula:
    C31H30N4O4

    M.W.:
    522.61

    Type:
    Unknown

    AlogP:
    4.65

    Polar Surface Area:
    127.50

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  11. ALA4593580

    Name:
    2-(3-(4-(tert-butyl)benzamido)phenyl)-4-((4-morpholinophenyl)amino)thiazoleShow More

    Mol. Formula:
    C31H32N4O4S

    M.W.:
    556.69

    Type:
    Unknown

    AlogP:
    6.64

    Polar Surface Area:
    103.79

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  12. ALA4592938

    Name:
    Ethyl 4-((4-(4-methylpiperazin-1-yl)phenyl)amino)-2-(3-(5-(trifluoromethyl)Show More

    Mol. Formula:
    C30H29F3N6O3S

    M.W.:
    610.66

    Type:
    Unknown

    AlogP:
    6.15

    Polar Surface Area:
    99.69

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  13. ALA4590761

    Name:
    2-(3-(3-chloro-4-fluorobenzamido)phenyl)-4-((4-(4-methylpiperazin-1-yl)phenShow More

    Mol. Formula:
    C28H25ClFN5O3S

    M.W.:
    566.06

    Type:
    Unknown

    AlogP:
    6.05

    Polar Surface Area:
    97.80

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  14. ALA4587485

    Name:
    2-(3-(4-(tert-butyl)benzamido)phenyl)-4-((4-(morpholine-4-carbonyl)phenyl)aShow More

    Mol. Formula:
    C32H33N5O4S

    M.W.:
    583.71

    Type:
    Unknown

    AlogP:
    5.67

    Polar Surface Area:
    126.65

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  15. ALA4585613

    Name:
    2-(3-(2-fluorobenzamido)phenyl)-4-((4-(4-methylpiperazin-1-yl)phenyl)amino)Show More

    Mol. Formula:
    C28H26FN5O3S

    M.W.:
    531.61

    Type:
    Unknown

    AlogP:
    5.40

    Polar Surface Area:
    97.80

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  16. ALA4584007

    Name:
    Ethyl 2-(3-(furan-2-carboxamido)phenyl)-4-((4-(4-methylpiperazin-1-yl)phenyShow More

    Mol. Formula:
    C28H29N5O4S

    M.W.:
    531.64

    Type:
    Unknown

    AlogP:
    5.33

    Polar Surface Area:
    99.94

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  17. ALA4579565

    Name:
    4-((4-(morpholine-4-carbonyl)phenyl)amino)-2-(3-(4-(trifluoromethyl)benzamiShow More

    Mol. Formula:
    C29H24F3N5O4S

    M.W.:
    595.60

    Type:
    Unknown

    AlogP:
    5.40

    Polar Surface Area:
    126.65

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  18. ALA4575423

    Name:
    2-(3-(3-fluorobenzamido)phenyl)-4-((4-(4-methylpiperazin-1-yl)phenyl)amino)Show More

    Mol. Formula:
    C28H26FN5O3S

    M.W.:
    531.61

    Type:
    Unknown

    AlogP:
    5.40

    Polar Surface Area:
    97.80

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  19. ALA4574567

    Name:
    Ethyl 2-(3-(4-(tert-butyl)benzamido)phenyl)-4-((4-(morpholine-4-carbonyl)phShow More

    Mol. Formula:
    C34H36N4O5S

    M.W.:
    612.75

    Type:
    Unknown

    AlogP:
    6.75

    Polar Surface Area:
    109.86

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.21

    DETAILS
  20. ALA4570521

    Name:
    2-(3-(3-fluorobenzamido)phenyl)-4-((4-(4-methylpiperazin-1-yl)phenyl)amino)Show More

    Mol. Formula:
    C28H27FN6O2S

    M.W.:
    530.63

    Type:
    Unknown

    AlogP:
    4.80

    Polar Surface Area:
    103.59

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.32

    DETAILS
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