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  1. ALA4474347

    Name:
    2,3-didodecanamidopropanoic acid

    Mol. Formula:
    C27H52N2O4

    M.W.:
    468.72

    Type:
    Unknown

    AlogP:
    6.51

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    24

    Passes Ro3:
    N

    QED Weighted:
    0.14

    DETAILS
  2. ALA4571417

    Name:
    (6S,9S,12S,15S,18S,21S,24S,27S,30S,33S,36S)-1-amin
    Show More

    Mol. Formula:
    C73H132N22O13S

    M.W.:
    1558.07

    Type:
    Unknown

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  3. ALA4528409

    Name:
    2,3-didecanamidopropanoic acid

    Mol. Formula:
    C23H44N2O4

    M.W.:
    412.62

    Type:
    Unknown

    AlogP:
    4.95

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    20

    Passes Ro3:
    N

    QED Weighted:
    0.25

    DETAILS
  4. ALA4758406

    Name:
    Hexaethylene glycol monododecyl ether

    Cas Number:
    3055-96-7

    Mol. Formula:
    C24H50O7

    M.W.:
    450.66

    Type:
    Unknown

    AlogP:
    4.00

    Polar Surface Area:
    75.61

    HBA:
    7

    HBD:
    1

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    28

    Passes Ro3:
    N

    QED Weighted:
    0.18

    DETAILS
  5. ALA4472227

    Name:
    2,4-didecanamidobutanoic acid

    Mol. Formula:
    C24H46N2O4

    M.W.:
    426.64

    Type:
    Unknown

    AlogP:
    5.34

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    21

    Passes Ro3:
    N

    QED Weighted:
    0.22

    DETAILS
  6. ALA4089744

    Name:
    N4-(6-methoxyquinolin-8-yl)pentane-1,4-diamine (E)
    Show More

    Mol. Formula:
    C24H28ClN3O3

    M.W.:
    441.96

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  7. ALA4072817

    Name:
    Methyl (2-{[7-(2-{[(S)-6-Amino-1-methoxy-1-oxohexa
    Show More

    Mol. Formula:
    C39H52N4O12

    M.W.:
    768.86

    Type:
    Small molecule

    AlogP:
    3.01

    Polar Surface Area:
    240.97

    HBA:
    14

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    22

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  8. ALA4071279

    Name:
    Dimethyl 2,2'-[(2,2'-{[5-Hydroxy-2-(4-methoxypheny
    Show More

    Mol. Formula:
    C39H42N6O12

    M.W.:
    786.79

    Type:
    Small molecule

    AlogP:
    2.69

    Polar Surface Area:
    246.29

    HBA:
    14

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    18

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  9. ALA4068877

    Name:
    Tetradecyl 5-(Fur-2-yl)uridin-5'-yl-2-N-bis(3-amin
    Show More

    Mol. Formula:
    C35H62N5O9P

    M.W.:
    727.88

    Type:
    Small molecule

    AlogP:
    4.34

    Polar Surface Area:
    208.50

    HBA:
    13

    HBD:
    5

    #RO5 Violations:
    2

    #Rotatable Bonds:
    28

    Passes Ro3:
    N

    QED Weighted:
    0.06

    DETAILS
  10. ALA4068623

    Name:
    N4-(6-methoxyquinolin-8-yl)pentane-1,4-diamine (E)
    Show More

    Mol. Formula:
    C27H35N3O3

    M.W.:
    449.60

    Type:
    Small molecule

    AlogP:
    ---

    Polar Surface Area:
    ---

    HBA:
    ---

    HBD:
    ---

    #RO5 Violations:
    na

    #Rotatable Bonds:
    ---

    Passes Ro3:
    ---

    QED Weighted:
    ---

    DETAILS
  11. ALA4550912

    Name:
    2,4-didodecanamidobutanoic acid

    Mol. Formula:
    C28H54N2O4

    M.W.:
    482.75

    Type:
    Unknown

    AlogP:
    6.90

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    1

    #Rotatable Bonds:
    25

    Passes Ro3:
    N

    QED Weighted:
    0.12

    DETAILS
  12. ALA4594131

    Name:
    2,3-dipalmitamidopropanoic acid

    Mol. Formula:
    C35H68N2O4

    M.W.:
    580.94

    Type:
    Unknown

    AlogP:
    9.63

    Polar Surface Area:
    95.50

    HBA:
    3

    HBD:
    3

    #RO5 Violations:
    2

    #Rotatable Bonds:
    32

    Passes Ro3:
    N

    QED Weighted:
    0.07

    DETAILS
  13. ALA5204380

    Name:
    1,3-bis(8-aminooctyl)-1,3-bis(8-carbamimidamidooct
    Show More

    Mol. Formula:
    C37H77F3N10O3

    M.W.:
    767.08

    Type:
    ---

    AlogP:
    5.96

    Polar Surface Area:
    199.39

    HBA:
    5

    HBD:
    8

    #RO5 Violations:
    3

    #Rotatable Bonds:
    34

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  14. ALA5176685

    Name:
    1,3,3-tris({8-[N'-(cyclopropylmethyl)carbamimidami
    Show More

    Mol. Formula:
    C48H95N11O

    M.W.:
    842.36

    Type:
    ---

    AlogP:
    9.66

    Polar Surface Area:
    167.28

    HBA:
    4

    HBD:
    9

    #RO5 Violations:
    3

    #Rotatable Bonds:
    40

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  15. ALA5175428

    Name:
    1,1-bis({6-[N'-(cyclopropylmethyl)carbamimidamido]
    Show More

    Mol. Formula:
    C44H87N11O

    M.W.:
    786.26

    Type:
    ---

    AlogP:
    8.10

    Polar Surface Area:
    167.28

    HBA:
    4

    HBD:
    9

    #RO5 Violations:
    3

    #Rotatable Bonds:
    36

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  16. ALA5174654

    Name:
    1,3,3-tris(8-carbamimidamidooctyl)-1-{8-[N'-(cyclo
    Show More

    Mol. Formula:
    C51H99F3N14O3

    M.W.:
    1013.44

    Type:
    ---

    AlogP:
    8.13

    Polar Surface Area:
    229.18

    HBA:
    5

    HBD:
    12

    #RO5 Violations:
    3

    #Rotatable Bonds:
    42

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  17. ALA5173833

    Name:
    1,1,3-tris({8-[N'-(cyclopropylmethyl)carbamimidami
    Show More

    Mol. Formula:
    C42H80F3N11O3

    M.W.:
    844.17

    Type:
    ---

    AlogP:
    6.59

    Polar Surface Area:
    176.07

    HBA:
    4

    HBD:
    10

    #RO5 Violations:
    3

    #Rotatable Bonds:
    33

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  18. ALA5171616

    Name:
    1-(8-aminooctyl)-1,3,3-tris(8-carbamimidamidooctyl
    Show More

    Mol. Formula:
    C36H78N12O

    M.W.:
    695.10

    Type:
    ---

    AlogP:
    5.48

    Polar Surface Area:
    235.27

    HBA:
    5

    HBD:
    10

    #RO5 Violations:
    3

    #Rotatable Bonds:
    35

    Passes Ro3:
    N

    QED Weighted:
    0.02

    DETAILS
  19. ALA5169836

    Name:
    1,1,3-tris(8-aminooctyl)-3-(8-carbamimidamidooctyl
    Show More

    Mol. Formula:
    C34H74N8O

    M.W.:
    611.02

    Type:
    ---

    AlogP:
    6.43

    Polar Surface Area:
    163.51

    HBA:
    5

    HBD:
    6

    #RO5 Violations:
    3

    #Rotatable Bonds:
    33

    Passes Ro3:
    N

    QED Weighted:
    0.03

    DETAILS
  20. ALA5169490

    Name:
    {8-[N'(cyclopropylmethyl)carbamimidamido]octyl}ure
    Show More

    Mol. Formula:
    C16H30F3N5O3

    M.W.:
    397.44

    Type:
    ---

    AlogP:
    1.52

    Polar Surface Area:
    103.03

    HBA:
    2

    HBD:
    5

    #RO5 Violations:
    ---

    #Rotatable Bonds:
    11

    Passes Ro3:
    N

    QED Weighted:
    0.23

    DETAILS
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