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  1. ALA450376

    Name:
    1-desgalloyleugeniin

    Mol. Formula:
    C34H26O22

    M.W.:
    786.56

    Type:
    Small molecule

    AlogP:
    0.69

    Polar Surface Area:
    377.42

    HBA:
    22

    HBD:
    13

    #RO5 Violations:
    3

    #Rotatable Bonds:
    4

    Passes Ro3:
    N

    QED Weighted:
    0.08

    DETAILS
  2. ALA453142

    Name:
    [(Hex)-(DHtyr)-(L-Htyr)-(D-Phe)]

    Mol. Formula:
    C35H43N3O7

    M.W.:
    617.74

    Type:
    Small molecule

    AlogP:
    4.03

    Polar Surface Area:
    165.06

    HBA:
    6

    HBD:
    6

    #RO5 Violations:
    2

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
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