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18 Items

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  1. ALA2268761

    Name:
    2-(2,4-Dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsilyl-2-pentanoShow More

    Mol. Formula:
    C16H23Cl2N3OSi

    M.W.:
    372.37

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  2. ALA2268760

    Name:
    2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsilyl-2-pentanoShow More

    Mol. Formula:
    C16H23F2N3OSi

    M.W.:
    339.46

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA2268759

    Name:
    2-Phenyl-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsilyl-2-pentanol

    Mol. Formula:
    C16H25N3OSi

    M.W.:
    303.48

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  4. ALA2268758

    Name:
    2-(4-Chlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsilyl-2-pentanol

    Mol. Formula:
    C16H24ClN3OSi

    M.W.:
    337.93

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  5. ALA2268757

    Name:
    2-(4-Fluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsilyl-2-pentanol

    Mol. Formula:
    C16H24FN3OSi

    M.W.:
    321.47

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  6. ALA2268756

    Name:
    2-(2,4-Dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C15H21Cl2N3OSi

    M.W.:
    358.34

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA2268755

    Name:
    2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C15H21F2N3OSi

    M.W.:
    325.43

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  8. ALA2268754

    Name:
    2-(4-Methoxyphenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C16H25N3O2Si

    M.W.:
    319.48

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  9. ALA2268753

    Name:
    2-(4-Methylphenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C16H25N3OSi

    M.W.:
    303.48

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  10. ALA2268752

    Name:
    2-Phenyl-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C15H23N3OSi

    M.W.:
    289.45

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA2268751

    Name:
    2-(4-Bromophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C15H22BrN3OSi

    M.W.:
    368.35

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  12. ALA2268750

    Name:
    2-(4-Chlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsilyl-2-butanol

    Mol. Formula:
    C15H22ClN3OSi

    M.W.:
    323.90

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  13. ALA2229596

    Name:
    [(1R,2S,8R,9S,10S,12R,13S,14S,17S,19R,20S,21R)-5-[(acetyloxy)methyl]-9,21-dShow More

    Mol. Formula:
    C38H44O11

    M.W.:
    676.76

    Type:
    Small molecule

    AlogP:
    3.08

    Polar Surface Area:
    162.73

    HBA:
    11

    HBD:
    2

    #RO5 Violations:
    2

    #Rotatable Bonds:
    6

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  14. ALA2228801

    Name:
    wilfoside C1N

    Mol. Formula:
    C56H90O19

    M.W.:
    1067.32

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  15. ALA2228800

    Name:
    wilfoside C1G

    Mol. Formula:
    C62H100O24

    M.W.:
    1229.46

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  16. ALA2228799

    Name:
    wilfoside C1GG

    Mol. Formula:
    C68H110O29

    M.W.:
    1391.60

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  17. ALA2228798

    Name:
    wilfoside K1N

    Mol. Formula:
    C58H86O19

    M.W.:
    1087.31

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  18. ALA2228797

    Name:
    wilfoside K1GG

    Mol. Formula:
    C70H106O29

    M.W.:
    1411.59

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
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