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  1. ALA5267643

    Name:
    (6S,9S,12S,15S,18S)-18-(((2S,3S)-1-(((3S,5S,11R,15R,18S,23aS)-5-((1H-indol-Show More

    Mol. Formula:
    C101H150N26O29S

    M.W.:
    2224.53

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  2. ALA5270477

    Name:
    (3S,6S,9S,12S,15S,18S,21S,24S,27S)-12-((1H-indol-3-yl)methyl)-27-((S)-2-((SShow More

    Mol. Formula:
    C105H132N26O31

    M.W.:
    2254.36

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA5270284

    Name:
    (4S,7S,10S,13S,16S,19S,22S)-4-carbamoyl-10,16-bis(2-carboxyethyl)-22-(2-(2-Show More

    Mol. Formula:
    C87H112N10O27

    M.W.:
    1729.90

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA5269304

    Name:
    N2-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-5-carbonyl)Show More

    Mol. Formula:
    C37H33IN2O9

    M.W.:
    776.58

    Type:
    ---

    AlogP:
    5.76

    Polar Surface Area:
    171.49

    HBA:
    8

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  5. ALA5282767

    Name:
    5-amino-N-(4-((6S,9S,12S,17aS,23S,26S,29S,34aS)-9-(4-(3-(3',6'-dihydroxy-3-Show More

    Mol. Formula:
    C97H115N21O20S

    M.W.:
    1927.18

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA5199198

    Name:
    (4S,7S,10S,13S,16S,19S,22S,49S,52S,55S,58S,61S,64S,67S,70S,73S,76S,79S,82S,Show More

    Mol. Formula:
    C207H330N48O63

    M.W.:
    4499.19

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA5194540

    Name:
    (4S,7S,10S,13S,16S,19S,22S,31S,34S,37S,40S,43S,46S,49S,52S,55S,58S,61S,64S,Show More

    Mol. Formula:
    C193H304N46O59

    M.W.:
    4212.82

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA5193167

    Name:
    (4S,7S,10S,13S,16S,19S,22S,52S,55S,58S,61S,64S,67S,70S,73S,76S,79S,82S,85S,Show More

    Mol. Formula:
    C210H336N48O63

    M.W.:
    4541.27

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA5191858

    Name:
    (4S,7S,10S,13S,16S,19S,22S,40S,43S,46S,49S,52S,55S,58S,61S,64S,67S,70S,73S,Show More

    Mol. Formula:
    C199H315N47O62

    M.W.:
    4357.98

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA5180864

    Name:
    (4S,7S,10S,13S,16S,19S,22S,40S,43S,46S,49S,52S,55S,58S,61S,64S,67S,70S,73S,Show More

    Mol. Formula:
    C201H319N47O60

    M.W.:
    4354.03

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA5179465

    Name:
    (4S,7S,10S,13S,16S,19S,22S,43S,46S,49S,52S,55S,58S,61S,64S,67S,70S,73S,76S,Show More

    Mol. Formula:
    C204H325N47O60

    M.W.:
    4396.11

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA5175517

    Name:
    (4S,7S,10S,13S,16S,19S,22S,49S,52S,55S,58S,61S,64S,67S,70S,73S,76S,79S,82S,Show More

    Mol. Formula:
    C205H326N48O65

    M.W.:
    4503.13

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA5094773

    Name:
    Nalpha-(4-Phenyl-triazol)-N-epsilon-(4-iodophenylbutanoyl)-D-lysine

    Mol. Formula:
    C24H27IN4O3

    M.W.:
    546.41

    Type:
    Unknown

    AlogP:
    4.48

    Polar Surface Area:
    97.11

    HBA:
    5

    HBD:
    2

    #RO5 Violations:
    1

    #Rotatable Bonds:
    12

    Passes Ro3:
    N

    QED Weighted:
    0.26

    DETAILS
  14. ALA5093981

    Name:
    N-alpha-(4-Pentynoyl)-N-epsilon-(4-(4-Iodophenyl)butanoyl)-D-lysine

    Mol. Formula:
    C21H27IN2O4

    M.W.:
    498.36

    Type:
    Unknown

    AlogP:
    2.88

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  15. ALA5093280

    Name:
    N-alpha-(5-Azidopentanoyl)-N-epsilon-(4-(4-iodophenyl)butanoyl)-L-lysine

    Mol. Formula:
    C21H30IN5O4

    M.W.:
    543.41

    Type:
    Unknown

    AlogP:
    3.95

    Polar Surface Area:
    144.26

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    16

    Passes Ro3:
    N

    QED Weighted:
    0.10

    DETAILS
  16. ALA5093259

    Name:
    Nalpha-Acetyl-N-epsilon-(4-(4-iodophenyl)butanoyl)-L-lysine methylester

    Mol. Formula:
    C19H27IN2O4

    M.W.:
    474.34

    Type:
    Unknown

    AlogP:
    2.58

    Polar Surface Area:
    84.50

    HBA:
    4

    HBD:
    2

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.29

    DETAILS
  17. ALA5093086

    Name:
    N-alpha-(4-Azidobenzoyl)-N-epsilon-(4-(4-methylphenyl)butanoyl)-L-lysine amShow More

    Mol. Formula:
    C24H30N6O3

    M.W.:
    450.54

    Type:
    Unknown

    AlogP:
    3.83

    Polar Surface Area:
    150.05

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  18. ALA5093073

    Name:
    N-alpha-(4-Azidobenzoyl)-N-epsilon-(4-(4-iodophenyl)butanoyl)-L-lysine

    Mol. Formula:
    C23H26IN5O4

    M.W.:
    563.40

    Type:
    Unknown

    AlogP:
    4.73

    Polar Surface Area:
    144.26

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.11

    DETAILS
  19. ALA5091965

    Name:
    N-alpha-(4-Azidobenzoyl)-N-epsilon-(4-phenylbutanoyl)-L-lysine

    Mol. Formula:
    C23H27N5O4

    M.W.:
    437.50

    Type:
    Unknown

    AlogP:
    4.12

    Polar Surface Area:
    144.26

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.19

    DETAILS
  20. ALA5091156

    Name:
    N-alpha-(4-Azidobenzoyl)-N-epsilon-(4-chlorophenylbutanoyl)-L-lysine

    Mol. Formula:
    C23H26ClN5O4

    M.W.:
    471.95

    Type:
    Unknown

    AlogP:
    4.77

    Polar Surface Area:
    144.26

    HBA:
    4

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    13

    Passes Ro3:
    N

    QED Weighted:
    0.17

    DETAILS
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