Compounds

ALA4878682

Name:
(R)-N-(1-(4-methoxyphenyl)ethyl)-6-(quinolin-6-yl)
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Mol. Formula:
C26H22N4O2

M.W.:
422.49

2 activity values

1 unique targets

Type:
Unknown

AlogP:
5.05

Polar Surface Area:
68.52

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4878429

Name:
N-(4-chlorobenzyl)-6-(1-methyl-1H-pyrazol-4-yl)imi
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Mol. Formula:
C19H16ClN5O

M.W.:
365.82

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.32

Polar Surface Area:
64.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4878376

Name:
(R)-N-(1-phenylethyl)-6-(quinolin-6-yl)imidazo[1,2
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Mol. Formula:
C25H20N4O

M.W.:
392.46

2 activity values

1 unique targets

Type:
Unknown

AlogP:
5.04

Polar Surface Area:
59.29

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4877125

Name:
(R)-6-(1-methyl-1H-pyrazol-4-yl)-N-(1-phenylethyl)
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Mol. Formula:
C20H19N5O

M.W.:
345.41

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.23

Polar Surface Area:
64.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4876285

Name:
N-(4-isopropoxybenzyl)-6-(1-methyl-1H-pyrazol-4-yl
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Mol. Formula:
C22H23N5O2

M.W.:
389.46

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.45

Polar Surface Area:
73.45

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4875425

Name:
(S)-N-(1-(4-methoxyphenyl)ethyl)-6-(1-methyl-1H-py
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Mol. Formula:
C21H21N5O2

M.W.:
375.43

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.23

Polar Surface Area:
73.45

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4874981

Name:
N-(4-methoxybenzyl)-6-(pyridin-4-yl)imidazo[1,2-a]
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Mol. Formula:
C21H18N4O2

M.W.:
358.40

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.33

Polar Surface Area:
68.52

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4871915

Name:
N-(4-methoxyphenyl)-6-(1-methyl-1H-pyrazol-4-yl)im
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Mol. Formula:
C19H17N5O2

M.W.:
347.38

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.00

Polar Surface Area:
73.45

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4871388

Name:
6-(3,5-dimethylisoxazol-4-yl)-N-(4-methoxybenzyl)i
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Mol. Formula:
C21H20N4O3

M.W.:
376.42

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.54

Polar Surface Area:
81.66

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4868417

Name:
(S)-N-(1-(4-methoxyphenyl)ethyl)-6-(quinolin-6-yl)
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Mol. Formula:
C26H22N4O2

M.W.:
422.49

2 activity values

1 unique targets

Type:
Unknown

AlogP:
5.05

Polar Surface Area:
68.52

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5286791

Name:
N-(6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-2-yl)-
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Mol. Formula:
C20H20N6O2

M.W.:
376.42

Type:
---

AlogP:
2.64

Polar Surface Area:
108.20

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA5283453

Name:
6-tert-butyl-N-(6-(pyridin-4-yl)imidazo[1,2-a]pyri
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Mol. Formula:
C22H21N5O

M.W.:
371.44

Type:
---

AlogP:
4.34

Polar Surface Area:
72.18

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5280284

Name:

Mol. Formula:
C18H10N4O3

M.W.:
330.30

Type:
---

AlogP:
2.16

Polar Surface Area:
99.53

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4867596

Name:
N-methyl-6-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-a
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Mol. Formula:
C13H13N5O

M.W.:
255.28

2 activity values

1 unique targets

Type:
Unknown

AlogP:
1.09

Polar Surface Area:
64.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4864799

Name:
(S)-N-(1-phenylethyl)-6-(quinolin-6-yl)imidazo[1,2
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Mol. Formula:
C25H20N4O

M.W.:
392.46

2 activity values

1 unique targets

Type:
Unknown

AlogP:
5.04

Polar Surface Area:
59.29

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4858661

Name:
N-(3-methoxybenzyl)-6-(quinolin-6-yl)imidazo[1,2-a
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Mol. Formula:
C25H20N4O2

M.W.:
408.46

2 activity values

1 unique targets

Type:
Unknown

AlogP:
4.49

Polar Surface Area:
68.52

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4791451

Name:
5-(1-methyl-1H-pyrazol-4-yl)-3-(3-(piperidin-4-yl)
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Mol. Formula:
C22H22N4O

M.W.:
358.45

10 activity values

10 unique targets

Type:
Unknown

AlogP:
4.36

Polar Surface Area:
55.88

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4790254

Name:
3-(4-tert-butylphenyl)-5-(1-methyl-1H-1,2,3-triazo
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Mol. Formula:
C20H20N4O

M.W.:
332.41

10 activity values

10 unique targets

Type:
Unknown

AlogP:
4.59

Polar Surface Area:
56.74

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4789951

Name:
3-(3-(1H-pyrazol-4-yl)phenyl)-5-(1-methyl-1H-pyraz
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Mol. Formula:
C20H15N5O

M.W.:
341.37

11 activity values

11 unique targets

Type:
Unknown

AlogP:
4.29

Polar Surface Area:
72.53

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA4861868

Name:
(R)-N-(1-(4-chlorophenyl)ethyl)-6-(1-methyl-1H-pyr
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Mol. Formula:
C20H18ClN5O

M.W.:
379.85

2 activity values

1 unique targets

Type:
Unknown

AlogP:
3.88

Polar Surface Area:
64.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS