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Compounds

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Items 1-20 of 93

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  1. ALA5221023

    Name:
    (S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxopropyl)Show More⌵

    Mol. Formula:
    C66H96IN19O21S4

    M.W.:
    1746.78

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  2. ALA5220652

    Name:
    (S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxopropyl)Show More⌵

    Mol. Formula:
    C66H96IN19O21S4

    M.W.:
    1746.78

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA5220622

    Name:
    (S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxopropyl)Show More⌵

    Mol. Formula:
    C64H92IN19O21S4

    M.W.:
    1718.72

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA5220467

    Name:
    (S)-5-amino-2-((S)-3-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-37-(2-amiShow More⌵

    Mol. Formula:
    C70H107IN22O20S4

    M.W.:
    1831.93

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  5. ALA5220455

    Name:
    (S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxopropyl)Show More⌵

    Mol. Formula:
    C64H93IN20O20S4

    M.W.:
    1717.74

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA5220113

    Name:
    (S)-2-((S)-3-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-37-(2-aminoacetamShow More⌵

    Mol. Formula:
    C70H104IN21O22S4

    M.W.:
    1846.90

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA5220060

    Name:
    (R)-2-((S)-3-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-37-(2-aminoacetamShow More⌵

    Mol. Formula:
    C71H109IN24O20S4

    M.W.:
    1873.97

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA5197873

    Name:

    Mol. Formula:
    C60H92N22O22S4

    M.W.:
    1601.80

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA5197651

    Name:

    Mol. Formula:
    C59H95N25O18S4

    M.W.:
    1570.83

    2  activity values

    2   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA5197395

    Name:
    2-((6S,12R,17R,20S,23S,25aS,31S,34S,40S,43R,46S,48aS,53R)-6-((1H-imidazol-5Show More⌵

    Mol. Formula:
    C60H93N23O21S4

    M.W.:
    1600.81

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA5196112

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,37S,40S,43R,46S,48aS,53R)-6-((1H-imiShow More⌵

    Mol. Formula:
    C63H98N22O22S4

    M.W.:
    1643.88

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA5204909

    Name:
    2-((6S,12R,17R,20S,23S,25aS,31S,34S,37S,40S,43R,46S,48aS,53R)-6-((1H-imidazShow More⌵

    Mol. Formula:
    C63H98N22O21S4

    M.W.:
    1627.88

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA5203956

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,37S,40S,43R,46S,48aS,53R)-6-((1H-imiShow More⌵

    Mol. Formula:
    C63H97N21O22S4

    M.W.:
    1628.86

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  14. ALA5203933

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,37S,43R,46S,48aS,53R)-6-((1H-imidazoShow More⌵

    Mol. Formula:
    C63H98N22O21S4

    M.W.:
    1627.88

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  15. ALA5202294

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,40S,43R,46S,48aS,53R)-6-((1H-imidazoShow More⌵

    Mol. Formula:
    C60H92N22O22S4

    M.W.:
    1601.80

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA5202012

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,37S,40S,43R,46S,48aS,53R)-6-((1H-imiShow More⌵

    Mol. Formula:
    C62H95N21O21S4

    M.W.:
    1598.84

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  17. ALA5199128

    Name:
    2-((6S,9S,12R,17R,20S,23S,25aS,31S,34S,37S,40S,43R,46S,48aS,53R)-31,34-bis(Show More⌵

    Mol. Formula:
    C59H93N19O22S4

    M.W.:
    1548.77

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA5219791

    Name:
    (S)-2-((S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxoShow More⌵

    Mol. Formula:
    C70H105IN24O21S4

    M.W.:
    1873.93

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  19. ALA5219752

    Name:
    (S)-6-amino-2-((S)-3-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-37-(2-amiShow More⌵

    Mol. Formula:
    C71H109IN22O20S4

    M.W.:
    1845.96

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  20. ALA5219354

    Name:
    (S)-2-((3S,6R,9S,12S,15S,18R,23R,26S,29S,34aS,37S)-15-(3-amino-3-oxopropyl)Show More⌵

    Mol. Formula:
    C64H92IN19O21S4

    M.W.:
    1718.72

    1  activity values

    1   unique targets

    Type:
    ---

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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