Compounds

Type:
Small molecule

AlogP:
2.72

Polar Surface Area:
73.49

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA1096502

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C22H27N5O2

M.W.:
393.49

Type:
Small molecule

AlogP:
2.72

Polar Surface Area:
73.49

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA1096205

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C22H27N5O2

M.W.:
393.49

Type:
Small molecule

AlogP:
2.72

Polar Surface Area:
73.49

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA1096204

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C22H27N5O

M.W.:
377.49

Type:
Small molecule

AlogP:
3.02

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA1096203

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

Mol. Formula:
C22H27N5O

M.W.:
377.49

Type:
Small molecule

AlogP:
3.02

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA1097852

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

Mol. Formula:
C22H27N5O

M.W.:
377.49

Type:
Small molecule

AlogP:
3.02

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA1097550

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C21H24ClN5O

M.W.:
397.91

Type:
Small molecule

AlogP:
3.36

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA1096153

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

Mol. Formula:
C21H24ClN5O

M.W.:
397.91

Type:
Small molecule

AlogP:
3.36

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA1096152

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

Mol. Formula:
C21H24ClN5O

M.W.:
397.91

Type:
Small molecule

AlogP:
3.36

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA1096151

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C21H24FN5O

M.W.:
381.45

Type:
Small molecule

AlogP:
2.85

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA1095858

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

Mol. Formula:
C21H24FN5O

M.W.:
381.45

Type:
Small molecule

AlogP:
2.85

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA1097156

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

Mol. Formula:
C21H24FN5O

M.W.:
381.45

Type:
Small molecule

AlogP:
2.85

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA1098198

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C23H29N5O

M.W.:
391.52

Type:
Small molecule

AlogP:
3.33

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA1098197

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

Mol. Formula:
C23H29N5O

M.W.:
391.52

Type:
Small molecule

AlogP:
3.33

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA1098196

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

Mol. Formula:
C23H29N5O

M.W.:
391.52

Type:
Small molecule

AlogP:
3.33

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA1098858

Name:
2-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C25H33N5O

M.W.:
419.57

Type:
Small molecule

AlogP:
3.83

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA1099131

Name:
1-(4-((1H-benzo[d]imidazol-2-yl)methyl)-1,4-diazep
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Mol. Formula:
C22H24F3N5O

M.W.:
431.46

Type:
Small molecule

AlogP:
3.73

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA1099130

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

Mol. Formula:
C22H24F3N5O

M.W.:
431.46

Type:
Small molecule

AlogP:
3.73

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA1098851

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

Mol. Formula:
C22H24F3N5O

M.W.:
431.46

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
3.73

Polar Surface Area:
64.26

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA1095090

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

Mol. Formula:
C22H27N5O2

M.W.:
393.49