Compounds

Type:
Small molecule

AlogP:
6.60

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA3273503

Name:
1-(2-(2,4-dichlorophenyl)-5-(4-methoxyphenoxy)pent
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Mol. Formula:
C23H24Cl2N2O6

M.W.:
495.36

Type:
Small molecule

AlogP:
5.84

Polar Surface Area:
36.28

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA3273502

Name:
1-(5-(4-bromophenoxy)-2-(2,4-dichlorophenyl)pentyl
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Mol. Formula:
C22H21BrCl2N2O5

M.W.:
544.23

Type:
Small molecule

AlogP:
6.60

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA3273501

Name:
1-(5-(4-chlorophenoxy)-2-(2,4-dichlorophenyl)penty
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Mol. Formula:
C22H21Cl3N2O5

M.W.:
499.78

Type:
Small molecule

AlogP:
6.49

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA3273500

Name:
1-(2-(2,4-dichlorophenyl)-5-(4-fluorophenoxy)penty
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Mol. Formula:
C22H21Cl2FN2O5

M.W.:
483.32

Type:
Small molecule

AlogP:
5.97

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA3273499

Name:
1-(2-(2,4-dichlorophenyl)-5-phenoxypentyl)-1H-imid
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Mol. Formula:
C22H22Cl2N2O5

M.W.:
465.33

Type:
Small molecule

AlogP:
5.83

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA3273498

Name:
1-(4-(2,4-dichlorophenoxy)-2-(2,4-dichlorophenyl)b
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Mol. Formula:
C21H18Cl4N2O5

M.W.:
520.20

Type:
Small molecule

AlogP:
6.75

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA3273497

Name:
1-(2-(2,4-dichlorophenyl)-4-(4-methoxyphenoxy)buty
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Mol. Formula:
C20H21Cl2N3O5

M.W.:
454.31

Type:
Small molecule

AlogP:
5.45

Polar Surface Area:
36.28

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA3273496

Name:
1-(4-(4-bromophenoxy)-2-(2,4-dichlorophenyl)butyl)
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Mol. Formula:
C19H18BrCl2N3O4

M.W.:
503.18

Type:
Small molecule

AlogP:
6.21

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA3273495

Name:
1-(4-(2-bromophenoxy)-2-(2,4-dichlorophenyl)butyl)
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Mol. Formula:
C21H19BrCl2N2O5

M.W.:
530.20

Type:
Small molecule

AlogP:
6.21

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA3273494

Name:
1-(4-(2-chlorophenoxy)-2-(2,4-dichlorophenyl)butyl
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Mol. Formula:
C21H19Cl3N2O5

M.W.:
485.75

Type:
Small molecule

AlogP:
6.10

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA3273493

Name:
1-(4-(4-chlorophenoxy)-2-(2,4-dichlorophenyl)butyl
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Mol. Formula:
C19H18Cl3N3O4

M.W.:
458.73

Type:
Small molecule

AlogP:
6.10

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA3273492

Name:
1-(2-(2,4-dichlorophenyl)-4-(4-fluorophenoxy)butyl
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Mol. Formula:
C21H19Cl2FN2O5

M.W.:
469.30

Type:
Small molecule

AlogP:
5.58

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA3273491

Name:
1-(2-(2,4-dichlorophenyl)-4-phenoxybutyl)-1H-imida
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Mol. Formula:
C21H20Cl2N2O5

M.W.:
451.31

Type:
Small molecule

AlogP:
5.44

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA3273490

Name:
1-(2-(4-bromophenyl)-3-(4-chlorophenoxy)propyl)-1H
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Mol. Formula:
C18H17BrClN3O4

M.W.:
454.71

Type:
Small molecule

AlogP:
5.16

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA3273489

Name:
1-(3-(4-chlorophenoxy)-2-(2,4-dichlorophenyl)propy
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Mol. Formula:
C18H16Cl3N3O4

M.W.:
444.70

Type:
Small molecule

AlogP:
5.71

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA3273488

Name:
1-(3-(4-chlorophenoxy)-2-(4-chlorophenyl)propyl)-1
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Mol. Formula:
C18H17Cl2N3O4

M.W.:
410.26

Type:
Small molecule

AlogP:
5.05

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3272367

Name:
1-(3-(2-chlorophenoxy)-2-(2,4-dichlorophenyl)propy
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Mol. Formula:
C18H16Cl3N3O4

M.W.:
444.70

Type:
Small molecule

AlogP:
5.71

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA3273487

Name:
1-(3-(2-chlorophenoxy)-2-(4-chlorophenyl)propyl)-1
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Mol. Formula:
C18H17Cl2N3O4

M.W.:
410.26

Type:
Small molecule

AlogP:
5.05

Polar Surface Area:
27.05

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3273486

Name:
1-(3-(2,4-dichlorophenoxy)-2-(2,4-dichlorophenyl)p
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Mol. Formula:
C18H15Cl4N3O4

M.W.:
479.15