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  1. ALA4550946

    Name:
    2,2-Dimethyl-4-(7-methoxy-1-methyl-beta-carbolin-9
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    Mol. Formula:
    C20H24N2O3

    M.W.:
    340.42

    Type:
    Unknown

    AlogP:
    4.10

    Polar Surface Area:
    53.35

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  2. ALA4575812

    Name:
    2-Methyl-4-(7-methoxy-1-methyl-beta-carbolin-9-yl)
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    Mol. Formula:
    C18H21N3O2

    M.W.:
    311.39

    Type:
    Unknown

    AlogP:
    3.02

    Polar Surface Area:
    70.14

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.79

    DETAILS
  3. ALA4563765

    Name:
    5-(7-Methoxy-1-methyl-beta-carbolin-9-yl)pentanami
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    Mol. Formula:
    C18H21N3O2

    M.W.:
    311.39

    Type:
    Unknown

    AlogP:
    3.16

    Polar Surface Area:
    70.14

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  4. ALA4442374

    Name:
    2-Methyl-4-(7-methoxy-1-methyl-beta-carbolin-9-yl)
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    Mol. Formula:
    C19H22N2O3

    M.W.:
    326.40

    Type:
    Unknown

    AlogP:
    3.71

    Polar Surface Area:
    53.35

    HBA:
    5

    HBD:
    ---

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.67

    DETAILS
  5. ALA213905

    Name:
    3-ethyl 6-methyl 4-(3-acetylphenylamino)quinoline-
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    Mol. Formula:
    C22H20N2O5

    M.W.:
    392.41

    Type:
    Small molecule

    AlogP:
    4.14

    Polar Surface Area:
    94.59

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
  6. ALA213351

    Name:
    4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-N-m-tolyl
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    Mol. Formula:
    C17H15N5S

    M.W.:
    321.41

    Type:
    Small molecule

    AlogP:
    4.21

    Polar Surface Area:
    55.11

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  7. ALA379386

    Name:
    N2-(4-bromophenyl)-N4-(furan-2-ylmethyl)quinazolin
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    Mol. Formula:
    C19H15BrN4O

    M.W.:
    395.26

    Type:
    Small molecule

    AlogP:
    5.34

    Polar Surface Area:
    62.98

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.48

    DETAILS
  8. ALA211705

    Name:
    5-(5-(2-(allyloxy)-5-bromobenzylidene)-4-oxo-4,5-d
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    Mol. Formula:
    C20H14BrClN2O4S

    M.W.:
    493.77

    Type:
    Small molecule

    AlogP:
    5.45

    Polar Surface Area:
    87.99

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  9. ALA212045

    Name:
    (Z)-3-(2-(4-fluorophenylamino)-4-oxothiazol-5(4H)-
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    Mol. Formula:
    C18H12FN3O2S

    M.W.:
    353.38

    Type:
    Small molecule

    AlogP:
    3.25

    Polar Surface Area:
    61.77

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    1

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  10. ALA265130

    Name:
    diethyl 4-(4-acetamidophenylamino)quinoline-3,6-di
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    Mol. Formula:
    C23H23N3O5

    M.W.:
    421.45

    Type:
    Small molecule

    AlogP:
    4.29

    Polar Surface Area:
    106.62

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  11. ALA209699

    Name:
    2-(5-(2-chlorophenyl)-1H-pyrazol-3-yl)-4-methoxyph
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    Mol. Formula:
    C16H13ClN2O2

    M.W.:
    300.75

    Type:
    Small molecule

    AlogP:
    4.11

    Polar Surface Area:
    58.14

    HBA:
    3

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.76

    DETAILS
  12. ALA211756

    Name:
    4-(4-hydroxy-3-methoxybenzylidene)-1-(3-chlorophen
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    Mol. Formula:
    C17H13ClN2O4

    M.W.:
    344.75

    Type:
    Small molecule

    AlogP:
    2.52

    Polar Surface Area:
    78.87

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  13. ALA209149

    Name:
    diethyl 4-(3-bromo-4-methylphenylamino)quinoline-3
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    Mol. Formula:
    C22H21BrN2O4

    M.W.:
    457.32

    Type:
    Small molecule

    AlogP:
    5.40

    Polar Surface Area:
    77.52

    HBA:
    6

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.50

    DETAILS
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