Compounds

Type:
Small molecule

AlogP:
3.85

Polar Surface Area:
31.92

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA541062

Name:
Benzyl-[2-(4-methoxy-phenyl)-3H-imidazol-4-ylmethy
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Mol. Formula:
C19H23Cl2N3O

M.W.:
380.32

Type:
Small molecule

AlogP:
3.72

Polar Surface Area:
41.15

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA555067

Name:
Benzyl-[2-(2-methoxy-phenyl)-3H-imidazol-4-ylmethy
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Mol. Formula:
C19H23Cl2N3O

M.W.:
380.32

Type:
Small molecule

AlogP:
3.72

Polar Surface Area:
41.15

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA555009

Name:
Benzyl-[2-(4-fluoro-phenyl)-3H-imidazol-4-ylmethyl
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Mol. Formula:
C18H20Cl2FN3

M.W.:
368.28

Type:
Small molecule

AlogP:
3.85

Polar Surface Area:
31.92

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA538753

Name:
Benzyl-[2-(2-fluoro-phenyl)-3H-imidazol-4-ylmethyl
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Mol. Formula:
C18H20Cl2FN3

M.W.:
368.28

Type:
Small molecule

AlogP:
3.85

Polar Surface Area:
31.92

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA538503

Name:
Benzyl-[2-(5-bromo-2,3-dimethoxy-phenyl)-3H-imidaz
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Mol. Formula:
C20H24BrCl2N3O2

M.W.:
489.24

Type:
Small molecule

AlogP:
4.49

Polar Surface Area:
50.38

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA538249

Name:
Benzyl-methyl-(2-phenyl-3H-imidazol-4-ylmethyl)-am
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Mol. Formula:
C18H21Cl2N3

M.W.:
350.29

Type:
Small molecule

AlogP:
3.71

Polar Surface Area:
31.92

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA541820

Name:
Benzyl-[2-(2,3-dimethoxy-phenyl)-3H-imidazol-4-ylm
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Mol. Formula:
C20H25Cl2N3O2

M.W.:
410.35

Type:
Small molecule

AlogP:
3.73

Polar Surface Area:
50.38

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA540284

Name:
Benzyl-[2-(3-methoxy-phenyl)-3H-imidazol-4-ylmethy
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Mol. Formula:
C19H23Cl2N3O

M.W.:
380.32

Type:
Small molecule

AlogP:
3.72

Polar Surface Area:
41.15

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA545460

Name:
Benzyl-[2-(3,4-dimethoxy-phenyl)-3H-imidazol-4-ylm
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Mol. Formula:
C20H25Cl2N3O2

M.W.:
410.35

Type:
Small molecule

AlogP:
3.73

Polar Surface Area:
50.38

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA543115

Name:
Benzyl-[2-(5-bromo-2-methoxy-phenyl)-3H-imidazol-4
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Mol. Formula:
C19H22BrCl2N3O

M.W.:
459.22

Type:
Small molecule

AlogP:
4.48

Polar Surface Area:
41.15

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA544059

Name:
Benzyl-[2-(5-chloro-2-methoxy-phenyl)-3H-imidazol-
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Mol. Formula:
C19H22Cl3N3O

M.W.:
414.76

Type:
Small molecule

AlogP:
4.37

Polar Surface Area:
41.15

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA146557

Name:
1-[1-(1-Phenyl-1H-pyrrol-3-ylmethyl)-piperidin-4-y
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Mol. Formula:
C23H24N4O

M.W.:
372.47

Type:
Small molecule

AlogP:
4.37

Polar Surface Area:
46.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA343466

Name:
1-(1-Phenyl-1H-pyrrol-3-ylmethyl)-4-pyridin-2-yl-p
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Mol. Formula:
C20H22N4

M.W.:
318.42

Type:
Small molecule

AlogP:
3.19

Polar Surface Area:
24.30

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA147731

Name:
4-Phenyl-1-(1-phenyl-1H-pyrrol-3-ylmethyl)-1,2,3,6
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Mol. Formula:
C22H22N2

M.W.:
314.43

Type:
Small molecule

AlogP:
4.77

Polar Surface Area:
8.17

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA446892

Name:
1-(1-Phenyl-1H-pyrrol-3-ylmethyl)-4-(3-trifluorome
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Mol. Formula:
C23H23F3N2O

M.W.:
400.44

Type:
Small molecule

AlogP:
4.98

Polar Surface Area:
28.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA144835

Name:
4-Phenyl-1-(1-phenyl-1H-pyrrol-3-ylmethyl)-piperid
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Mol. Formula:
C22H24N2

M.W.:
316.45

Type:
Small molecule

AlogP:
4.86

Polar Surface Area:
8.17

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA147003

Name:
4-(4-Chloro-phenyl)-1-(1-phenyl-1H-pyrrol-3-ylmeth
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Mol. Formula:
C22H23ClN2O

M.W.:
366.89

Type:
Small molecule

AlogP:
4.61

Polar Surface Area:
28.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA356542

Name:
1-Phenyl-8-(1-phenyl-1H-pyrrol-3-ylmethyl)-1,3,8-t
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Mol. Formula:
C24H26N4O

M.W.:
386.50

Type:
Small molecule

AlogP:
3.41

Polar Surface Area:
40.51

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA343657

Name:
1-Phenyl-4-(1-phenyl-1H-pyrrol-3-ylmethyl)-piperaz
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Mol. Formula:
C21H23N3

M.W.:
317.44