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  1. ALA4587287

    Name:
    Brachangobinan C

    Mol. Formula:
    C30H40O9

    M.W.:
    544.64

    Type:
    Unknown

    AlogP:
    5.08

    Polar Surface Area:
    120.75

    HBA:
    9

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.30

    DETAILS
  2. ALA4575213

    Name:
    Brachangobinan K

    Mol. Formula:
    C23H26O8

    M.W.:
    430.45

    Type:
    Unknown

    AlogP:
    3.48

    Polar Surface Area:
    119.36

    HBA:
    8

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    10

    Passes Ro3:
    N

    QED Weighted:
    0.33

    DETAILS
  3. ALA4574570

    Name:
    Brachangobinan F

    Mol. Formula:
    C15H20O6

    M.W.:
    296.32

    Type:
    Unknown

    AlogP:
    1.53

    Polar Surface Area:
    93.06

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.59

    DETAILS
  4. ALA4569889

    Name:
    Brachangobinan D

    Mol. Formula:
    C30H38O9

    M.W.:
    542.63

    Type:
    Unknown

    AlogP:
    5.23

    Polar Surface Area:
    117.59

    HBA:
    9

    HBD:
    1

    #RO5 Violations:
    2

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.24

    DETAILS
  5. ALA4559835

    Name:
    Brachangobinan B

    Mol. Formula:
    C25H30O7

    M.W.:
    442.51

    Type:
    Unknown

    AlogP:
    4.21

    Polar Surface Area:
    102.29

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.31

    DETAILS
  6. ALA4559458

    Name:
    Brachangobinan J

    Mol. Formula:
    C23H26O8

    M.W.:
    430.45

    Type:
    Unknown

    AlogP:
    3.91

    Polar Surface Area:
    111.52

    HBA:
    7

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.61

    DETAILS
  7. ALA4559041

    Name:
    Brachangobinan G

    Mol. Formula:
    C15H22O6

    M.W.:
    298.34

    Type:
    Unknown

    AlogP:
    1.38

    Polar Surface Area:
    96.22

    HBA:
    6

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.66

    DETAILS
  8. ALA4540243

    Name:
    coniferyl isovalerate

    Mol. Formula:
    C15H20O4

    M.W.:
    264.32

    Type:
    Unknown

    AlogP:
    3.00

    Polar Surface Area:
    55.76

    HBA:
    4

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.80

    DETAILS
  9. ALA4529433

    Name:
    Brachangobinan I

    Mol. Formula:
    C23H26O7

    M.W.:
    414.45

    Type:
    Unknown

    AlogP:
    4.03

    Polar Surface Area:
    91.29

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.52

    DETAILS
  10. ALA4526707

    Name:
    3-acetoxymethyl-5-[(E)-2-formylethen-1-yl]-2-(4-hydroxy-3-methoxyphenyl)-7-Show More

    Mol. Formula:
    C22H22O7

    M.W.:
    398.41

    Type:
    Unknown

    AlogP:
    3.40

    Polar Surface Area:
    91.29

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    7

    Passes Ro3:
    N

    QED Weighted:
    0.43

    DETAILS
  11. ALA4513330

    Name:
    Brachangobinan E

    Mol. Formula:
    C16H24O6

    M.W.:
    312.36

    Type:
    Unknown

    AlogP:
    2.04

    Polar Surface Area:
    85.22

    HBA:
    6

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    8

    Passes Ro3:
    N

    QED Weighted:
    0.71

    DETAILS
  12. ALA4248268

    Name:
    14-Bromotetradecyl 4-hydroxy-2-methylbenzoate

    Mol. Formula:
    C22H35BrO3

    M.W.:
    427.42

    Type:
    Small molecule

    AlogP:
    6.93

    Polar Surface Area:
    46.53

    HBA:
    3

    HBD:
    1

    #RO5 Violations:
    1

    #Rotatable Bonds:
    15

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
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