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  1. ALA5193232

    Name:
    methyl (2S)-2-[[4-[[(2S)-2-amino-3-sulfanyl-propyl]amino]-2-phenyl-benzoyl]Show More

    Mol. Formula:
    C22H29N3O3S2

    M.W.:
    447.63

    Type:
    ---

    AlogP:
    3.05

    Polar Surface Area:
    93.45

    HBA:
    7

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  2. ALA4856110

    Name:
    2-(4-((6,7-dimethoxy-2-(5-methylfuran-2-yl)quinolin-4-ylamino)methyl)piperiShow More

    Mol. Formula:
    C27H30N6O5

    M.W.:
    518.57

    Type:
    Unknown

    AlogP:
    4.06

    Polar Surface Area:
    134.87

    HBA:
    10

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
  3. ALA4852593

    Name:
    N-hydroxy-2-(4-((6-methoxy-2-(5-methylfuran-2-yl)-7-(3-(pyrrolidin-1-yl)proShow More

    Mol. Formula:
    C33H41N7O5

    M.W.:
    615.74

    Type:
    Unknown

    AlogP:
    4.91

    Polar Surface Area:
    138.11

    HBA:
    11

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  4. ALA4800000

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C41H42ClFN6O7S

    M.W.:
    817.34

    Type:
    Unknown

    AlogP:
    6.98

    Polar Surface Area:
    145.40

    HBA:
    13

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  5. ALA4799768

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C33H33ClN4O5S

    M.W.:
    633.17

    Type:
    Unknown

    AlogP:
    6.28

    Polar Surface Area:
    101.16

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  6. ALA4799110

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C35H33ClF4N4O6S

    M.W.:
    749.18

    Type:
    Unknown

    AlogP:
    7.36

    Polar Surface Area:
    110.39

    HBA:
    10

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  7. ALA4797647

    Name:
    (2R)-2-[((5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C32H37ClN4O5S

    M.W.:
    625.19

    Type:
    Unknown

    AlogP:
    5.59

    Polar Surface Area:
    97.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  8. ALA4796848

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C45H41ClFN7O5S

    M.W.:
    846.38

    Type:
    Unknown

    AlogP:
    8.26

    Polar Surface Area:
    135.92

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  9. ALA4794417

    Name:
    (2R)-3-(2-[(1-Butyl-1H-pyrazol-5-yl)methoxy]phenyl)-2-([(5Sa)-5-(3-chloro-2Show More

    Mol. Formula:
    C41H44ClFN6O6S

    M.W.:
    803.36

    Type:
    Unknown

    AlogP:
    8.00

    Polar Surface Area:
    128.21

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  10. ALA4790907

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C44H43ClN6O6S

    M.W.:
    819.38

    Type:
    Unknown

    AlogP:
    7.44

    Polar Surface Area:
    132.26

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  11. ALA4790371

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C36H34ClF3N4O5S

    M.W.:
    727.21

    Type:
    Unknown

    AlogP:
    7.11

    Polar Surface Area:
    97.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  12. ALA4788164

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C36H36ClFN4O5S

    M.W.:
    691.23

    Type:
    Unknown

    AlogP:
    6.84

    Polar Surface Area:
    97.25

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.15

    DETAILS
  13. ALA4788011

    Name:
    (2R)-3-[2-[(2-butylpyrazol-3-yl)methoxy]phenyl]-2-[[(5Sa)-5-[3-chloro-2-metShow More

    Mol. Formula:
    C41H45ClFN7O5S

    M.W.:
    802.37

    Type:
    Unknown

    AlogP:
    8.03

    Polar Surface Area:
    131.01

    HBA:
    12

    HBD:
    2

    #RO5 Violations:
    3

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.09

    DETAILS
  14. ALA4782220

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C45H41ClFN7O5S

    M.W.:
    846.38

    Type:
    Unknown

    AlogP:
    8.26

    Polar Surface Area:
    135.92

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  15. ALA4781465

    Name:
    (2R)-2-[((5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C35H35ClN4O4S

    M.W.:
    643.21

    Type:
    Unknown

    AlogP:
    6.69

    Polar Surface Area:
    88.02

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  16. ALA4779395

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C38H40ClFN4O7S

    M.W.:
    751.28

    Type:
    Unknown

    AlogP:
    6.98

    Polar Surface Area:
    119.62

    HBA:
    11

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.13

    DETAILS
  17. ALA4779285

    Name:
    (2R)-3-(2-[(1-tert-Butyl-1H-pyrazol-5-yl)methoxy]phenyl)-2-([(5Sa)-5-(3-chlShow More

    Mol. Formula:
    C41H44ClFN6O6S

    M.W.:
    803.36

    Type:
    Unknown

    AlogP:
    7.95

    Polar Surface Area:
    128.21

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  18. ALA4776828

    Name:
    (2R)-3-(2-[(1-Butyl-1H-pyrazol-5-yl)methoxy]phenyl)-2-([(5Sa)-5-(3-chloro-2Show More

    Mol. Formula:
    C43H46ClFN6O5S

    M.W.:
    813.40

    Type:
    Unknown

    AlogP:
    8.40

    Polar Surface Area:
    115.07

    HBA:
    11

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  19. ALA4776083

    Name:
    (2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More

    Mol. Formula:
    C46H43ClFN7O5S

    M.W.:
    860.41

    Type:
    Unknown

    AlogP:
    8.57

    Polar Surface Area:
    135.92

    HBA:
    12

    HBD:
    1

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  20. ALA4776023

    Name:
    (2R)-2-[(6-Acetyl-(5Sa)-5-(3-chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)eShow More

    Mol. Formula:
    C31H33ClN4O5S

    M.W.:
    609.15

    Type:
    Unknown

    AlogP:
    5.22

    Polar Surface Area:
    105.09

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
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