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  1. ALA5276585

    Name:
    3-(3-methyl-1-{5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-amido)Show More

    Mol. Formula:
    C23H28N6O3

    M.W.:
    436.52

    Type:
    ---

    AlogP:
    3.43

    Polar Surface Area:
    103.45

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  2. ALA5269145

    Name:
    methyl 2-{3-[4-(aminomethyl)-1-{6-fluoro-5H,6H,7H,8H,9H-pyrimido[4,5-b]indoShow More

    Mol. Formula:
    C26H31FN6O3

    M.W.:
    494.57

    Type:
    ---

    AlogP:
    2.68

    Polar Surface Area:
    126.23

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  3. ALA5268230

    Name:
    3-[(3R)-3-methyl-1-{5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-aShow More

    Mol. Formula:
    C23H28N6O3

    M.W.:
    436.52

    Type:
    ---

    AlogP:
    3.43

    Polar Surface Area:
    103.45

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.65

    DETAILS
  4. ALA3798412

    Name:
    methyl 2-(3-(4-(aminomethyl)-1-(6,6-difluoro-6,7,8,9-tetrahydro-5H-pyrimidoShow More

    Mol. Formula:
    C26H30F2N6O3

    M.W.:
    512.56

    Type:
    Small molecule

    AlogP:
    2.98

    Polar Surface Area:
    126.23

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  5. ALA3799270

    Name:
    methyl 2-(3-(1-(6,6-difluoro-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yShow More

    Mol. Formula:
    C27H32F2N6O3

    M.W.:
    526.59

    Type:
    Small molecule

    AlogP:
    3.34

    Polar Surface Area:
    103.45

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  6. ALA3799932

    Name:
    (3-{[4-Aminomethyl-1-(5,6,7,8-tetrahydro-cyclopenta[4,5]pyrrolo[2,3-d]pyrimShow More

    Mol. Formula:
    C25H30N6O3

    M.W.:
    462.55

    Type:
    Small molecule

    AlogP:
    2.35

    Polar Surface Area:
    126.23

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  7. ALA3800261

    Name:
    (3-{[4-Dimethylamino-1-(5,6,7,8-tetrahydro-cyclopenta[4,5]pyrrolo[2,3-d]pyrShow More

    Mol. Formula:
    C26H32N6O3

    M.W.:
    476.58

    Type:
    Small molecule

    AlogP:
    2.70

    Polar Surface Area:
    103.45

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.53

    DETAILS
  8. ALA3798651

    Name:
    methyl 2-(3-(4-(aminomethyl)-1-(6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-Show More

    Mol. Formula:
    C26H32N6O3

    M.W.:
    476.58

    Type:
    Small molecule

    AlogP:
    2.74

    Polar Surface Area:
    126.23

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.47

    DETAILS
  9. ALA3797937

    Name:
    methyl 3-(4-(aminomethyl)-1-(6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yShow More

    Mol. Formula:
    C25H30N6O3

    M.W.:
    462.55

    Type:
    Small molecule

    AlogP:
    2.81

    Polar Surface Area:
    126.23

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  10. ALA3797658

    Name:
    3-(1-(6,6-difluoro-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)-4-(dimeShow More

    Mol. Formula:
    C27H33F2N7O3

    M.W.:
    541.60

    Type:
    Small molecule

    AlogP:
    3.68

    Polar Surface Area:
    106.69

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.51

    DETAILS
  11. ALA3797634

    Name:
    Dimethyl-carbamic acid 3-{[4-dimethylamino-1-(5,6,7,8-tetrahydro-cyclopentaShow More

    Mol. Formula:
    C26H33N7O3

    M.W.:
    491.60

    Type:
    Small molecule

    AlogP:
    3.05

    Polar Surface Area:
    106.69

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.56

    DETAILS
  12. ALA3799318

    Name:
    N-(3-(1,2,4-oxadiazol-5-yl)phenyl)-4-(dimethylamino)-1-(6,7,8,9-tetrahydro-Show More

    Mol. Formula:
    C26H30N8O2

    M.W.:
    486.58

    Type:
    Small molecule

    AlogP:
    3.43

    Polar Surface Area:
    116.07

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  13. ALA3798275

    Name:
    N-(3-(1H-1,2,4-triazol-1-yl)phenyl)-4-(dimethylamino)-1-(6,7,8,9-tetrahydroShow More

    Mol. Formula:
    C26H31N9O

    M.W.:
    485.60

    Type:
    Small molecule

    AlogP:
    2.96

    Polar Surface Area:
    107.86

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  14. ALA3799695

    Name:
    4-(dimethylamino)-N-(3-(oxazol-5-yl)phenyl)-1-(6,7,8,9-tetrahydro-5H-pyrimiShow More

    Mol. Formula:
    C27H31N7O2

    M.W.:
    485.59

    Type:
    Small molecule

    AlogP:
    4.03

    Polar Surface Area:
    103.18

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.44

    DETAILS
  15. ALA3798270

    Name:
    N-(3-(1H-pyrazol-3-yl)phenyl)-4-(dimethylamino)-1-(6,7,8,9-tetrahydro-5H-pyShow More

    Mol. Formula:
    C27H32N8O

    M.W.:
    484.61

    Type:
    Small molecule

    AlogP:
    3.77

    Polar Surface Area:
    105.83

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  16. ALA3799358

    Name:
    N-(3-(1H-imidazol-1-yl)phenyl)-4-(dimethylamino)-1-(6,7,8,9-tetrahydro-5H-pShow More

    Mol. Formula:
    C27H32N8O

    M.W.:
    484.61

    Type:
    Small molecule

    AlogP:
    3.56

    Polar Surface Area:
    94.97

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  17. ALA3800357

    Name:
    4-(dimethylamino)-1-(6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)-N-(3-Show More

    Mol. Formula:
    C28H32N6OS

    M.W.:
    500.67

    Type:
    Small molecule

    AlogP:
    5.10

    Polar Surface Area:
    77.15

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.40

    DETAILS
  18. ALA3799925

    Name:
    4-(dimethylamino)-N-(3-(furan-2-yl)phenyl)-1-(6,7,8,9-tetrahydro-5H-pyrimidShow More

    Mol. Formula:
    C28H32N6O2

    M.W.:
    484.60

    Type:
    Small molecule

    AlogP:
    4.64

    Polar Surface Area:
    90.29

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  19. ALA3798662

    Name:
    N-(3-(1H-pyrrol-1-yl)phenyl)-4-(dimethylamino)-1-(6,7,8,9-tetrahydro-5H-pyrShow More

    Mol. Formula:
    C28H33N7O

    M.W.:
    483.62

    Type:
    Small molecule

    AlogP:
    4.17

    Polar Surface Area:
    82.08

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.45

    DETAILS
  20. ALA3798361

    Name:
    4-(dimethylamino)-N-(3-(pyridin-4-yl)phenyl)-1-(6,7,8,9-tetrahydro-5H-pyrimShow More

    Mol. Formula:
    C29H33N7O

    M.W.:
    495.63

    Type:
    Small molecule

    AlogP:
    4.44

    Polar Surface Area:
    90.04

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
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