Compounds

Type:
Unknown

AlogP:
4.48

Polar Surface Area:
54.50

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4877779

Name:
(E)-3-(4-bromophenyl)-2-(N-phenylbenzimidazol-2-yl)acrylonitrile

Mol. Formula:
C22H14BrN3

M.W.:
400.28

Type:
Unknown

AlogP:
5.85

Polar Surface Area:
41.61

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4877762

Name:
(E/Z)-2-(N-isobutylbenzimidazol-2-yl)-3-(4-N,N-dimethylaminophenyl)acryloniShow More⌵

Mol. Formula:
C22H24N4

M.W.:
344.46

12 activity values

Type:
Unknown

AlogP:
4.82

Polar Surface Area:
44.85

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4875812

Name:
(E/Z)-2-(N-isobutylbenzimidazol-2-yl)-3-(4-nitrophenyl)acrylonitrile

Mol. Formula:
C20H18N4O2

M.W.:
346.39

Type:
Unknown

AlogP:
4.66

Polar Surface Area:
84.75

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4874091

Name:
(E)-2-(N-phenylbenzimidazol-2-yl)-3-(1H-pyrrol-2-yl)acrylonitrile

Mol. Formula:
C20H14N4

M.W.:
310.36

Type:
Unknown

AlogP:
4.42

Polar Surface Area:
57.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4870750

Name:
(E/Z)-2-(5-cyano-N-isobutylbenzimidazol-2-yl)-3-(4-N,N-dimethylaminophenyl)Show More⌵

Mol. Formula:
C23H23N5

M.W.:
369.47

12 activity values

Type:
Unknown

AlogP:
4.69

Polar Surface Area:
68.64

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4870446

Name:
(E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(quinolin-3-yl)acrylonitrile

Mol. Formula:
C20H14N4

M.W.:
310.36

Type:
Unknown

AlogP:
4.19

Polar Surface Area:
54.50

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4869953

Name:
(E)-2-(N-methylbenzimidazol-2-yl)-3-(pyridin-3-yl)acrylonitrile

Mol. Formula:
C16H12N4

M.W.:
260.30

Type:
Unknown

AlogP:
3.03

Polar Surface Area:
54.50

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4869185

Name:
(E)-2-(N-phenylbenzimidazol-2-yl)-3-(quinolin-3-yl)acylonitrile

Mol. Formula:
C25H16N4

M.W.:
372.43

Type:
Unknown

AlogP:
5.64

Polar Surface Area:
54.50

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4864889

Name:
(E)-2-(5-cyano-N-methylbenzimidazol-2-yl)-3-(4-N,N-dimethylaminophenyl)actyShow More⌵

Mol. Formula:
C20H17N5

M.W.:
327.39

Type:
Unknown

AlogP:
3.58

Polar Surface Area:
68.64

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA4860768

Name:
(E)-3-(1H-indol-3-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile

Mol. Formula:
C19H14N4

M.W.:
298.35

Type:
Unknown

AlogP:
4.12

Polar Surface Area:
57.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4859700

Name:
(E)-3-(4-bromophenyl)-2-(N-methylbenzimidazol-2-yl)acrylonitrile

Mol. Formula:
C17H12BrN3

M.W.:
338.21

Type:
Unknown

AlogP:
4.40

Polar Surface Area:
41.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4855042

Name:
(E)-2-(5-cyano-N-phenylbenzimidazol-2-yl)-3-(4-N,N-dimethylaminophenyl)acryShow More⌵

Mol. Formula:
C25H19N5

M.W.:
389.46

Type:
Unknown

AlogP:
5.03

Polar Surface Area:
68.64

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4849466

Name:
(E)-2-(N-isobutylbenzimidazol-2-yl)-3-phenylacrylonitrile

Mol. Formula:
C20H19N3

M.W.:
301.39

Type:
Unknown

AlogP:
4.76

Polar Surface Area:
41.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4848866

Name:
(E)-3-(1H-indol-3-yl)-2-(N-phenylbenzimidazol-2-yl)acrylonitrile

Mol. Formula:
C24H16N4

M.W.:
360.42

Type:
Unknown

AlogP:
5.57

Polar Surface Area:
57.40

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4845819

Name:
(E)-2-(N-methylbenzimidazol-2-yl)-3-(1H-pyrrol-2-yl)acrylonitrile

Mol. Formula:
C15H12N4

M.W.:
248.29

Type:
Unknown

AlogP:
2.97

Polar Surface Area:
57.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
Y

QED Weighted:
0.71

DETAILS

ALA4786168

Name:
2-(2-(4-Dimethylaminobenzylidene)hydrazinyl)-4-(1-methyl-1H-benzo[d]imidazoShow More⌵

Mol. Formula:
C20H20N6S

M.W.:
376.49

3 activity values

Type:
Unknown

AlogP:
4.21

Polar Surface Area:
58.34

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4783948

Name:
4-(1-methyl-1H-benzo[d]imidazol-2-yl)-2-(2-(4-methylbenzylidene)hydrazinyl)Show More⌵

Mol. Formula:
C19H17N5S

M.W.:
347.45

3 activity values

Type:
Unknown

AlogP:
4.45

Polar Surface Area:
55.10

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4753631

Name:
4-(1-Methyl-1H-benzo[d]imidazol-2-yl)-2-(2-(4-nitrobenzylidene)hydrazinyl)tShow More⌵

Mol. Formula:
C18H14N6O2S

M.W.:
378.42

4 activity values

Type:
Unknown

AlogP:
4.05

Polar Surface Area:
98.24

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4752843

Name:
2-(2-(4-Fluorobenzylidene)hydrazinyl)-4-(1-methyl-1H-benzo[d]imdazol-2-yl)tShow More⌵

Mol. Formula:
C18H14FN5S

M.W.:
351.41

3 activity values