Compounds

Type:
Small molecule

AlogP:
4.82

Polar Surface Area:
72.28

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA3981321

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(piperidin-1-yl)-1Himidazo[4,5-c][1,7]naphthShow More⌵

Mol. Formula:
C21H19N7

M.W.:
369.43

Type:
Small molecule

AlogP:
3.84

Polar Surface Area:
75.52

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA3980906

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(thiophen-3-yl)-1H-imidazo[4,5-c][1,7]naphthShow More⌵

Mol. Formula:
C20H12N6S

M.W.:
368.43

2 activity values

Type:
Small molecule

AlogP:
4.57

Polar Surface Area:
72.28

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA3966844

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(pyridin-4-yl)-1H-imidazo[4,5-c][1,7]naphthyShow More⌵

Mol. Formula:
C21H13N7

M.W.:
363.38

Type:
Small molecule

AlogP:
3.91

Polar Surface Area:
85.17

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA3955726

Name:
4-(1-(1H-benzo[d]imidazol-6-yl)-1H-imidazo[4,5-c]-[1,7]naphthyridin-8-yl)isShow More⌵

Mol. Formula:
C19H11N7S

M.W.:
369.41

Type:
Small molecule

AlogP:
3.97

Polar Surface Area:
85.17

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA3944315

Name:
(S)-N-(1-morpholinopropan-2-yl)-6-(8-(pyridin-4-yl)-1H-imidazo[4,5-c][1,7]nShow More⌵

Mol. Formula:
C30H28N8O

M.W.:
516.61

3 activity values

Type:
Small molecule

AlogP:
4.71

Polar Surface Area:
93.88

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA3939592

Name:
rac-N-(1-morpholinopropan-2-yl)-6-(8-(pyridin-4-yl)-1H-imidazo[4,5-c][1,7]nShow More⌵

Mol. Formula:
C30H28N8O

M.W.:
516.61

57 activity values

5 unique targets

Type:
Small molecule

AlogP:
4.71

Polar Surface Area:
93.88

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA3937721

Name:
2-(4-(8-(thiophen-3-yl)-1H-imidazo[4,5-c][1,7]-naphthyridin-1-yl)phenyl)aceShow More⌵

Mol. Formula:
C21H13N5S

M.W.:
367.44

2 activity values

Type:
Small molecule

AlogP:
4.76

Polar Surface Area:
67.39

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA3937086

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(pyridin-3-yl)-1H-imidazo[4,5-c][1,7]naphthyShow More⌵

Mol. Formula:
C21H13N7

M.W.:
363.38

Type:
Small molecule

AlogP:
3.91

Polar Surface Area:
85.17

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA3936462

Name:
2-methyl-6-(8-phenyl-1H-imidazo[4,5-c][1,7]-naphthyridin-1-yl)benzo[d]thiazShow More⌵

Mol. Formula:
C23H15N5S

M.W.:
393.48

3 activity values

Type:
Small molecule

AlogP:
5.55

Polar Surface Area:
56.49

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA3928698

Name:
2-(4-(8-(thiophen-3-yl)-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)acetonitrile

Mol. Formula:
C22H14N4S

M.W.:
366.45

2 activity values

Type:
Small molecule

AlogP:
5.37

Polar Surface Area:
54.50

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA3928098

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(1H-pyrazol-4-yl)-1Himidazo[4,5-c][1,7]naphtShow More⌵

Mol. Formula:
C19H12N8

M.W.:
352.36

Type:
Small molecule

AlogP:
3.24

Polar Surface Area:
100.96

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA3927501

Name:
N-(1-morpholinopropan-2-yl)-6-(8-phenyl-1Himidazo[4,5-c][1,7]naphthyridin-1Show More⌵

Mol. Formula:
C29H27N7OS

M.W.:
521.65

8 activity values

3 unique targets

Type:
Small molecule

AlogP:
5.38

Polar Surface Area:
80.99

HBA:
9

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA3919207

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-phenyl-1H-imidazo-[4,5-c][1,7]naphthyridine

Mol. Formula:
C22H14N6

M.W.:
362.40

Type:
Small molecule

AlogP:
4.51

Polar Surface Area:
72.28

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA3918552

Name:
N-(1-morpholinopropan-2-yl)-6-(8-(thiophen-2-yl)-1H-imidazo[4,5-c][1,7]naphShow More⌵

Mol. Formula:
C27H25N7OS2

M.W.:
527.68

17 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.44

Polar Surface Area:
80.99

HBA:
10

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA3912476

Name:
(R)-N-(1-morpholinopropan-2-yl)-6-(8-(pyridin-4-yl)-1H-imidazo[4,5-c][1,7]nShow More⌵

Mol. Formula:
C30H28N8O

M.W.:
516.61

8 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.71

Polar Surface Area:
93.88

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA3911325

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(cyclohex-1-en-1-yl)-1H-imidazo[4,5-c][1,7]nShow More⌵

Mol. Formula:
C22H18N6

M.W.:
366.43

Type:
Small molecule

AlogP:
4.80

Polar Surface Area:
72.28

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA3910848

Name:
1-(quinolin-6-yl)-8-(thiophen-3-yl)-1H-imidazo[4,5-c]-[1,7]naphthyridine

Mol. Formula:
C22H13N5S

M.W.:
379.45

13 activity values

5 unique targets

Type:
Small molecule

AlogP:
5.25

Polar Surface Area:
56.49

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA3910291

Name:
1-(1H-benzo[d]imidazol-6-yl)-8-(m-tolyl)-1H-imidazo-[4,5-c][1,7]naphthyridiShow More⌵

Mol. Formula:
C23H16N6

M.W.:
376.42