Compounds

Type:
Unknown

AlogP:
2.72

Polar Surface Area:
64.34

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4744618

Name:
3-(2-cyclopropoxypyridin-4-yl)-6-methoxy-5-(1-meth
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Mol. Formula:
C19H18N6O2

M.W.:
362.39

Type:
Unknown

AlogP:
2.74

Polar Surface Area:
79.36

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4741913

Name:
3-(2-Methoxypyridin-4-yl)-N-methyl-6-vinylpyrazolo
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Mol. Formula:
C15H15N5O

M.W.:
281.32

Type:
Unknown

AlogP:
2.48

Polar Surface Area:
64.34

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4741185

Name:
6-Ethyl-3-(2-methoxypyridin-4-yl)-N-methylpyrazolo
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Mol. Formula:
C15H17N5O

M.W.:
283.34

Type:
Unknown

AlogP:
2.40

Polar Surface Area:
64.34

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4764416

Name:
2-(6-methoxy-3-(2-methoxypyridin-4-yl)pyrazolo[1,5
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Mol. Formula:
C16H18N4O3

M.W.:
314.35

Type:
Unknown

AlogP:
2.04

Polar Surface Area:
81.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4764221

Name:
5-(3-(2-cyclopropoxypyridin-4-yl)-5-(1-methyl-1H-p
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Mol. Formula:
C24H28N6O3

M.W.:
448.53

Type:
Unknown

AlogP:
3.66

Polar Surface Area:
99.59

HBA:
9

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4763627

Name:
5-(6-methoxy-3-(2-methoxypyridin-4-yl)pyrazolo[1,5
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Mol. Formula:
C17H15N5O3

M.W.:
337.34

Type:
Unknown

AlogP:
2.77

Polar Surface Area:
87.57

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4763122

Name:
5-ethyl-6-methoxy-3-(2-methoxypyridin-4-yl)pyrazol
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Mol. Formula:
C15H16N4O2

M.W.:
284.32

4 activity values

3 unique targets

Type:
Unknown

AlogP:
2.37

Polar Surface Area:
61.54

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4758580

Name:
3-(2-isopropoxypyridin-4-yl)-6-methoxy-5-(1-methyl
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Mol. Formula:
C19H20N6O2

M.W.:
364.41

Type:
Unknown

AlogP:
2.99

Polar Surface Area:
79.36

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4779579

Name:
3-(2-Methoxypyridin-4-yl)-N,6-dimethylpyrazolo[1,5
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Mol. Formula:
C14H15N5O

M.W.:
269.31

Type:
Unknown

AlogP:
2.15

Polar Surface Area:
64.34

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4779273

Name:
6-methoxy-3-(2-methoxypyridin-4-yl)-5-(tetrahydrof
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Mol. Formula:
C17H18N4O3

M.W.:
326.36

Type:
Unknown

AlogP:
2.31

Polar Surface Area:
70.77

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4777071

Name:
6-methoxy-3-(2-methoxypyridin-4-yl)-N,N-dimethylpy
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Mol. Formula:
C15H17N5O2

M.W.:
299.33

Type:
Unknown

AlogP:
1.87

Polar Surface Area:
64.78

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4783244

Name:
3,6-Dioxa-9-aza-1(3,5)-pyrazolo[1,5-a]pyrimidina-2
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Mol. Formula:
C16H16N4O2

M.W.:
296.33

4 activity values

Type:
Unknown

AlogP:
2.22

Polar Surface Area:
60.68

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA4782729

Name:
5-cyclopentyl-6-methoxy-3-(2-methoxypyridin-4-yl)p
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Mol. Formula:
C18H20N4O2

M.W.:
324.38

Type:
Unknown

AlogP:
3.47

Polar Surface Area:
61.54

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4752199

Name:
6-Methoxy-3-(2-methoxypyridin-4-yl)-N-methylpyrazo
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Mol. Formula:
C14H15N5O2

M.W.:
285.31

7 activity values

5 unique targets

Type:
Unknown

AlogP:
1.85

Polar Surface Area:
73.57

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4751832

Name:
4-((3-(2-Cyclopropoxypyridin-4-yl)-5-(1-methyl-1H-
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Mol. Formula:
C23H26N6O3

M.W.:
434.50

24 activity values

12 unique targets

Type:
Unknown

AlogP:
3.27

Polar Surface Area:
99.59

HBA:
9

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4795223

Name:
3-(2-methoxypyridin-4-yl)-N-methylpyrazolo[1,5-a]p
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Mol. Formula:
C13H13N5O

M.W.:
255.28

Type:
Unknown

AlogP:
1.84

Polar Surface Area:
64.34

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4792978

Name:
3-Amino-N-cyclohexyl-6-(p-tolyl)pyrazine-2-carboxa
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Mol. Formula:
C18H22N4O

M.W.:
310.40

4 activity values

3 unique targets

Type:
Unknown

AlogP:
3.10

Polar Surface Area:
80.90

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.91

DETAILS

ALA4792464

Name:
(S)-5-(5,5-dimethyltetrahydrofuran-3-yl)-6-methoxy
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Mol. Formula:
C19H22N4O3

M.W.:
354.41