Compounds

Type:
Unknown

AlogP:
6.48

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4474143

Name:
N-((2-(4-chlorophenyl)imidazo[1,2-a]pyrimidin-3-yl
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Mol. Formula:
C21H17Cl3N4

M.W.:
431.75

Type:
Unknown

AlogP:
5.69

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4522917

Name:
2-(4-Chlorophenyl)-N-((6-(4-chlorophenyl)imidazo[2
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Mol. Formula:
C20H17Cl2N3S

M.W.:
402.35

5 activity values

Type:
Unknown

AlogP:
5.70

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4568159

Name:
N-((6-(4-chlorophenyl)imidazo[2,1-b]thiazol-5-yl)m
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Mol. Formula:
C20H17ClFN3S

M.W.:
385.90

Type:
Unknown

AlogP:
5.19

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4527619

Name:
N-((6-(4-chlorophenyl)imidazo[2,1-b]thiazol-5-yl)m
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Mol. Formula:
C20H16Cl3N3S

M.W.:
436.80

6 activity values

Type:
Unknown

AlogP:
6.36

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4516382

Name:
N-((6-(4-chlorophenyl)-2-methylimidazo[2,1-b]thiaz
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Mol. Formula:
C21H18Cl3N3S

M.W.:
450.82

Type:
Unknown

AlogP:
6.66

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA4577011

Name:
N-((6-(4-Bromophenyl)imidazo[2,1-b]thiazol-5-yl)me
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Mol. Formula:
C20H16BrCl2N3S

M.W.:
481.25

Type:
Unknown

AlogP:
6.46

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4576432

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C23H17N3O2

M.W.:
367.41

7 activity values

3 unique targets

Type:
Unknown

AlogP:
5.30

Polar Surface Area:
52.03

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4574886

Name:
2-(3,4-Dichlorophenyl)-N-((6-(4-(trifluoromethyl)p
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Mol. Formula:
C21H16Cl2F3N3S

M.W.:
470.35

Type:
Unknown

AlogP:
6.72

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4574159

Name:
2-(3,4-Dichlorophenyl)-N-((6-(4-methoxyphenyl)imid
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Mol. Formula:
C21H19Cl2N3OS

M.W.:
432.38

Type:
Unknown

AlogP:
5.71

Polar Surface Area:
38.56

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4580898

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C25H19N3O2

M.W.:
393.45

Type:
Unknown

AlogP:
5.27

Polar Surface Area:
52.03

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4580512

Name:
(E)-6-ethylimidazo[2,1-b]thiazole-5-carbaldehyde O
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Mol. Formula:
C15H13Cl2N3OS

M.W.:
354.26

Type:
Unknown

AlogP:
4.82

Polar Surface Area:
38.89

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4579387

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C24H19N3O3

M.W.:
397.43

Type:
Unknown

AlogP:
5.31

Polar Surface Area:
61.26

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4584424

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C29H21N3O3

M.W.:
459.51

6 activity values

3 unique targets

Type:
Unknown

AlogP:
7.09

Polar Surface Area:
61.26

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.19

DETAILS

ALA4582135

Name:
(E)-4-(5-((((3,4-Dichlorobenzyl)oxy)imino)methyl)i
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Mol. Formula:
C20H12Cl2N4OS

M.W.:
427.32

Type:
Unknown

AlogP:
5.79

Polar Surface Area:
62.68

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4463067

Name:
(E)-6-(4-Methoxyphenyl)imidazo[2,1-b]thiazole-5-ca
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Mol. Formula:
C20H15Cl2N3O2S

M.W.:
432.33

Type:
Unknown

AlogP:
5.93

Polar Surface Area:
48.12

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4466818

Name:
N-Benzyl-1-(6-(4-chlorophenyl)imidazo[2,1-b]thiazo
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Mol. Formula:
C19H16ClN3S

M.W.:
353.88

Type:
Unknown

AlogP:
5.01

Polar Surface Area:
29.33

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4466018

Name:
(E)-6-(3-Chlorophenyl)imidazo[2,1-b]thiazole-5-car
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Mol. Formula:
C19H12Cl3N3OS

M.W.:
436.75

Type:
Unknown

AlogP:
6.57

Polar Surface Area:
38.89

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4465050

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C23H15Cl2N3O2

M.W.:
436.30

11 activity values

3 unique targets

Type:
Unknown

AlogP:
6.61

Polar Surface Area:
52.03

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA4471991

Name:
(E)-6-(Naphthalen-2-yl)imidazo[2,1-b]oxazole-5-car
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Mol. Formula:
C27H25N3O2

M.W.:
423.52