Compounds

ALA2273071

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(4-chlorophenyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C16H11ClN4OS

M.W.:
342.81

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.56

Polar Surface Area:
67.60

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA2268530

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(2-chlorophenyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C16H11ClN4OS

M.W.:
342.81

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.56

Polar Surface Area:
67.60

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA2273070

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(3-chlorophenyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C16H11ClN4OS

M.W.:
342.81

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.56

Polar Surface Area:
67.60

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA2273069

Name:
2-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-5-phenyl-1,3,4-oxadiazole

Mol. Formula:
C17H14N4OS

M.W.:
322.39

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.21

Polar Surface Area:
67.60

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA2273068

Name:
2-(4-chlorophenyl)-5-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-1,3,4-Show More⌵

Mol. Formula:
C17H13ClN4OS

M.W.:
356.84

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.87

Polar Surface Area:
67.60

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA2273067

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-phenyl-1,3,4-thiadiazole

Mol. Formula:
C16H12N4S2

M.W.:
324.43

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.37

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA2273066

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(4-chlorophenyl)-1,3,4-thiadiazoShow More⌵

Mol. Formula:
C16H11ClN4S2

M.W.:
358.88

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
5.03

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA2273065

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(pyridin-4-yl)-1,3,4-thiadiazole

Mol. Formula:
C15H11N5S2

M.W.:
325.42

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.77

Polar Surface Area:
67.35

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA2273064

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(3-chlorophenyl)-1,3,4-thiadiazoShow More⌵

Mol. Formula:
C16H11ClN4S2

M.W.:
358.88

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
5.03

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA2273063

Name:
2-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(2-chlorophenyl)-1,3,4-thiadiazoShow More⌵

Mol. Formula:
C16H11ClN4S2

M.W.:
358.88

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
5.03

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA2273062

Name:
2-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-5-phenyl-1,3,4-thiadiazolShow More⌵

Mol. Formula:
C17H14N4S2

M.W.:
338.46

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.68

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA2273061

Name:
2-(3-chlorophenyl)-5-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-1,3,4-Show More⌵

Mol. Formula:
C17H13ClN4S2

M.W.:
372.91

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
5.34

Polar Surface Area:
54.46

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA2273060

Name:
3-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(4-chlorophenyl)-4H-1,2,4-triazoShow More⌵

Mol. Formula:
C16H13ClN6S

M.W.:
356.84

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.48

Polar Surface Area:
85.41

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA2273059

Name:
3-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(2-chlorophenyl)-4H-1,2,4-triazoShow More⌵

Mol. Formula:
C16H13ClN6S

M.W.:
356.84

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.48

Polar Surface Area:
85.41

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA2273058

Name:
3-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(3-chlorophenyl)-4H-1,2,4-triazoShow More⌵

Mol. Formula:
C16H13ClN6S

M.W.:
356.84

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.48

Polar Surface Area:
85.41

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA2273057

Name:
3-((1H-benzo[d]imidazol-2-yl)methylthio)-5-(pyridin-4-yl)-4H-1,2,4-triazol-Show More⌵

Mol. Formula:
C15H13N7S

M.W.:
323.39

29 activity values

15 unique targets

Type:
Small molecule

AlogP:
2.22

Polar Surface Area:
98.30

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA2273056

Name:
3-(3-chlorophenyl)-5-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-4H-1,2Show More⌵

Mol. Formula:
C17H15ClN6S

M.W.:
370.87

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.79

Polar Surface Area:
85.41

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA2273055

Name:
3-((5-methyl-1H-benzo[d]imidazol-2-yl)methylthio)-5-phenyl-4H-1,2,4-triazolShow More⌵

Mol. Formula:
C17H16N6S

M.W.:
336.42

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
3.14

Polar Surface Area:
85.41

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA2273054

Name:
2-((1H-benzo[d]imidazol-2-ylthio)methyl)-5-methyl-1H-benzo[d]imidazole

Mol. Formula:
C16H14N4S

M.W.:
294.38

26 activity values

13 unique targets

Type:
Small molecule

AlogP:
4.04

Polar Surface Area:
57.36

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.56

DETAILS