Compounds

Type:
Unknown

AlogP:
3.98

Polar Surface Area:
95.05

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA4791315

Name:
(S)-N-(4-chlorophenyl)-2-(3-(4-chlorophenyl)-1,2,4
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Mol. Formula:
C19H16Cl2N4O2

M.W.:
403.27

Type:
Unknown

AlogP:
5.41

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4791236

Name:
(S)-N-(4-chlorophenyl)-2-(3-(3-chlorophenyl)-1,2,4
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Mol. Formula:
C19H16Cl2N4O2

M.W.:
403.27

Type:
Unknown

AlogP:
5.41

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4791010

Name:
(S)-N-(4-bromophenyl)-2-(3-phenyl-1,2,4-oxadiazol-
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Mol. Formula:
C19H17BrN4O2

M.W.:
413.27

Type:
Unknown

AlogP:
4.87

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4790784

Name:
(S)-N-(4-fluorophenyl)-2-(3-phenyl-1,2,4-oxadiazol
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Mol. Formula:
C19H17FN4O2

M.W.:
352.37

Type:
Unknown

AlogP:
4.24

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4790367

Name:
(S)-N-(2-acetylphenyl)-2-(3-phenyl-1,2,4-oxadiazol
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Mol. Formula:
C21H20N4O3

M.W.:
376.42

Type:
Unknown

AlogP:
4.31

Polar Surface Area:
88.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA4790279

Name:
(S)-N-(4-chlorophenyl)-2-(3-(3-methoxyphenyl)-1,2,
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Mol. Formula:
C20H19ClN4O3

M.W.:
398.85

Type:
Unknown

AlogP:
4.77

Polar Surface Area:
80.49

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4789632

Name:
(S)-N-(4-methoxyphenyl)-2-(3-phenyl-1,2,4-oxadiazo
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Mol. Formula:
C20H20N4O3

M.W.:
364.41

Type:
Unknown

AlogP:
4.11

Polar Surface Area:
80.49

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4789619

Name:
(S)-N-(4-hydroxyphenyl)-2-(3-phenyl-1,2,4-oxadiazo
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Mol. Formula:
C19H18N4O3

M.W.:
350.38

Type:
Unknown

AlogP:
3.81

Polar Surface Area:
91.49

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4849237

Name:
5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-bis((3
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Mol. Formula:
C28H32O15

M.W.:
608.55

1 activity values

1 unique targets

Type:
Unknown

AlogP:
-0.71

Polar Surface Area:
238.20

HBA:
15

HBD:
8

#RO5 Violations:
3

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.17

DETAILS

ALA4782333

Name:
(R)-N-(4-chlorophenyl)-2-(3-phenyl-1,2,4-oxadiazol
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Mol. Formula:
C19H17ClN4O2

M.W.:
368.82

Type:
Unknown

AlogP:
4.76

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4781469

Name:
(S)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-4
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Mol. Formula:
C18H17N5O2

M.W.:
335.37

Type:
Unknown

AlogP:
3.50

Polar Surface Area:
84.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4776542

Name:
(S)-N-(4-chlorophenyl)-2-(3-(4-iodophenyl)-1,2,4-o
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Mol. Formula:
C19H16ClIN4O2

M.W.:
494.72

Type:
Unknown

AlogP:
5.36

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA5271594

Name:
3-hydroxy-7,8-dimethoxyserrulat-14-en-19-oic acid
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Mol. Formula:
C23H34O5

M.W.:
390.52

Type:
---

AlogP:
4.82

Polar Surface Area:
64.99

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA4796098

Name:
(S)-N-(4-iodophenyl)-2-(3-phenyl-1,2,4-oxadiazol-5
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Mol. Formula:
C19H17IN4O2

M.W.:
460.27

Type:
Unknown

AlogP:
4.71

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4796017

Name:
(S)-N-(2-fluorophenyl)-2-(3-phenyl-1,2,4-oxadiazol
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Mol. Formula:
C19H17FN4O2

M.W.:
352.37

Type:
Unknown

AlogP:
4.24

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4795754

Name:
(S)-N-(4-(N,N-dimethylsulfamoyl)phenyl)-2-(3-pheny
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Mol. Formula:
C21H23N5O4S

M.W.:
441.51

Type:
Unknown

AlogP:
3.36

Polar Surface Area:
108.64

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4795452

Name:
(S)-N-(4-chlorophenyl)-2-(3-(4-fluorophenyl)-1,2,4
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Mol. Formula:
C19H16ClFN4O2

M.W.:
386.81

Type:
Unknown

AlogP:
4.90

Polar Surface Area:
71.26

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA4795413

Name:
(S)-N-(3-bromophenyl)-2-(3-phenyl-1,2,4-oxadiazol-
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Mol. Formula:
C19H17BrN4O2

M.W.:
413.27