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  1. ALA5203960

    Name:
    Phenazostatin I

    Mol. Formula:
    C30H22N4O5

    M.W.:
    518.53

    Type:
    ---

    AlogP:
    5.48

    Polar Surface Area:
    146.39

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  2. ALA5201379

    Name:
    (3E,5R,6R,7E,9E,12E)-5-hydroxy-14-(4-hydroxy-5,6-dimethoxy-2-pyridyl)-4,6,8Show More

    Mol. Formula:
    C26H37NO5

    M.W.:
    443.58

    Type:
    ---

    AlogP:
    5.11

    Polar Surface Area:
    88.88

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  3. ALA5201045

    Name:
    Phenazostatin H

    Mol. Formula:
    C30H22N4O5

    M.W.:
    518.53

    Type:
    ---

    AlogP:
    5.48

    Polar Surface Area:
    146.39

    HBA:
    7

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  4. ALA5198861

    Name:
    (R)-6-(1-((2-aminobenzoyl)oxy)ethyl)phenazine-1-carboxylic acid

    Mol. Formula:
    C22H17N3O4

    M.W.:
    387.40

    Type:
    ---

    AlogP:
    3.98

    Polar Surface Area:
    115.40

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  5. ALA5198610

    Name:
    (2S,3S,4R,5R,6S)-2-[(1S,2R,3E,5E,8E)-10-(4-hydroxy-5,6-dimethoxy-3-methyl-2Show More

    Mol. Formula:
    C30H45NO9

    M.W.:
    563.69

    Type:
    ---

    AlogP:
    2.89

    Polar Surface Area:
    150.96

    HBA:
    10

    HBD:
    5

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  6. ALA5183099

    Name:
    (R)-6-(1-((6-acetylphenazine-1-carbonyl)oxy)ethyl)phenazine-1-carboxylic acShow More

    Mol. Formula:
    C30H20N4O5

    M.W.:
    516.51

    Type:
    ---

    AlogP:
    5.70

    Polar Surface Area:
    132.23

    HBA:
    8

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
  7. ALA4781181

    Name:
    3-((2-oxo-5-(2-phenylthiazol-4-yl)indolin-3-ylidene)methyl)-2H-isoindole-1-Show More

    Mol. Formula:
    C27H17N3O3S

    M.W.:
    463.52

    Type:
    Unknown

    AlogP:
    6.15

    Polar Surface Area:
    95.08

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.28

    DETAILS
  8. ALA4644735

    Name:
    Pestalotioquinoside B

    Mol. Formula:
    C27H34O8

    M.W.:
    486.56

    Type:
    Unknown

    AlogP:
    3.04

    Polar Surface Area:
    136.68

    HBA:
    7

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    9

    Passes Ro3:
    N

    QED Weighted:
    0.20

    DETAILS
  9. ALA4643909

    Name:
    Pestalotioquinol A

    Mol. Formula:
    C21H28O4

    M.W.:
    344.45

    Type:
    Unknown

    AlogP:
    3.64

    Polar Surface Area:
    80.92

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  10. ALA4643085

    Name:
    Pestalotioquinol E; (E)-2-(7,11-dimethyl-3-methylenedodeca-6,10-dien-1-yn-1Show More

    Mol. Formula:
    C21H26O2

    M.W.:
    310.44

    Type:
    Unknown

    AlogP:
    5.48

    Polar Surface Area:
    40.46

    HBA:
    2

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  11. ALA4641268

    Name:
    Pestalotioquinoside C

    Mol. Formula:
    C22H28O6

    M.W.:
    388.46

    Type:
    Unknown

    AlogP:
    2.25

    Polar Surface Area:
    99.38

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    5

    Passes Ro3:
    N

    QED Weighted:
    0.46

    DETAILS
  12. ALA4640786

    Name:
    Pestalotioquinol C; (Z)-6-(2,5-dihydroxyphenyl)-4-methylhex-3-en-5-ynoic acShow More

    Mol. Formula:
    C13H12O4

    M.W.:
    232.24

    Type:
    Unknown

    AlogP:
    1.87

    Polar Surface Area:
    77.76

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    2

    Passes Ro3:
    N

    QED Weighted:
    0.54

    DETAILS
  13. ALA4637756

    Name:
    Pestalotioquinoside A

    Mol. Formula:
    C27H36O6

    M.W.:
    456.58

    Type:
    Unknown

    AlogP:
    3.98

    Polar Surface Area:
    99.38

    HBA:
    6

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.35

    DETAILS
  14. ALA4636495

    Name:
    Pestalotioquinol D

    Mol. Formula:
    C13H12O4

    M.W.:
    232.24

    Type:
    Unknown

    AlogP:
    1.87

    Polar Surface Area:
    77.76

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    3

    Passes Ro3:
    N

    QED Weighted:
    0.55

    DETAILS
  15. ALA4635695

    Name:
    Pestalotioquinol F

    Mol. Formula:
    C22H28O5

    M.W.:
    372.46

    Type:
    Unknown

    AlogP:
    3.64

    Polar Surface Area:
    97.99

    HBA:
    4

    HBD:
    4

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.41

    DETAILS
  16. ALA4592766

    Name:
    2-[(9R,10R)-10-[(2S,3S)-2,3-dimethyloxiran-2-yl]-10-hydroxy-3,5,7,9-tetrameShow More

    Mol. Formula:
    C26H39NO5

    M.W.:
    445.60

    Type:
    Unknown

    AlogP:
    5.06

    Polar Surface Area:
    84.34

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  17. ALA4587720

    Name:
    5-Hydroxy-6-hydroxymethyl glucopiericidin A

    Mol. Formula:
    C32H51NO11

    M.W.:
    625.76

    Type:
    Unknown

    AlogP:
    2.10

    Polar Surface Area:
    180.42

    HBA:
    12

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  18. ALA4580920

    Name:
    10-Ketone piericidin A

    Mol. Formula:
    C25H35NO4

    M.W.:
    413.56

    Type:
    Unknown

    AlogP:
    5.67

    Polar Surface Area:
    68.65

    HBA:
    5

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  19. ALA4572057

    Name:
    2-hydroxymethyl-delta3,4-glucopiericidin A

    Mol. Formula:
    C32H49NO10

    M.W.:
    607.74

    Type:
    Unknown

    AlogP:
    2.91

    Polar Surface Area:
    160.19

    HBA:
    11

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    14

    Passes Ro3:
    N

    QED Weighted:
    0.16

    DETAILS
  20. ALA4555843

    Name:
    13-Hydroxypiericidin A 10-O-alpha-D-galactose(1->6)-beta-D-glucoside

    Mol. Formula:
    C37H57NO15

    M.W.:
    755.86

    Type:
    Unknown

    AlogP:
    0.08

    Polar Surface Area:
    250.34

    HBA:
    16

    HBD:
    9

    #RO5 Violations:
    3

    #Rotatable Bonds:
    17

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
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