Compounds

Type:
Unknown

AlogP:
2.76

Polar Surface Area:
92.17

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4525269

Name:
8-(4-(1-(Cyclobutylmethyl)piperidin-4-yl)-1H-pyraz
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Mol. Formula:
C20H24N6O

M.W.:
364.45

26 activity values

Type:
Unknown

AlogP:
2.48

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4560811

Name:
8-(4-(1-Ethylpiperidin-4-yl)-1H-pyrazol-1-yl)pyrid
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Mol. Formula:
C17H20N6O

M.W.:
324.39

Type:
Unknown

AlogP:
1.70

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4559561

Name:
8-(4-(2-(4-(4-(Pyridin-3-yl)phenyl)piperidin-1-yl)
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Mol. Formula:
C28H27N7O

M.W.:
477.57

Type:
Unknown

AlogP:
3.99

Polar Surface Area:
92.59

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4558689

Name:
8-(4-(2-(4-(3-(Pyrimidin-5-yl)phenyl)piperidin-1-y
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Mol. Formula:
C27H26N8O

M.W.:
478.56

Type:
Unknown

AlogP:
3.38

Polar Surface Area:
105.48

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4553540

Name:
8-(4-(2-(4-(3-(2-Morpholinoethyl)-5-(trifluorometh
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Mol. Formula:
C30H34F3N7O2

M.W.:
581.64

Type:
Unknown

AlogP:
3.82

Polar Surface Area:
92.17

HBA:
8

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA4538741

Name:
8-(4-(2-(4-(3-Methoxyphenyl)piperidin-1-yl)ethyl)-
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Mol. Formula:
C24H26N6O2

M.W.:
430.51

Type:
Unknown

AlogP:
2.93

Polar Surface Area:
88.93

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA4532069

Name:
8-(4-(1-(Cyclopropylmethyl)piperidin-4-yl)-1H-pyra
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Mol. Formula:
C19H22N6O

M.W.:
350.43

Type:
Unknown

AlogP:
2.09

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA4529932

Name:
8-(4-(1-Cyclopentylpiperidin-4-yl)-1H-pyrazol-1-yl
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Mol. Formula:
C20H24N6O

M.W.:
364.45

Type:
Unknown

AlogP:
2.63

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4483792

Name:
8-(4-(1-((1-Methyl-1H-pyrazol-4-yl)methyl)piperidi
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Mol. Formula:
C20H22N8O

M.W.:
390.45

Type:
Unknown

AlogP:
1.62

Polar Surface Area:
97.52

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4483780

Name:
8-[4-(1-Methylpiperidin-4-yl)-1H-pyrazol-1-yl]pyri
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Mol. Formula:
C16H18N6O

M.W.:
310.36

Type:
Unknown

AlogP:
1.31

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4476629

Name:
8-(4-(2-(4-(3-Isopropylphenyl)piperidin-1-yl)ethyl
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Mol. Formula:
C26H30N6O

M.W.:
442.57

Type:
Unknown

AlogP:
4.05

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4522584

Name:
8-(4-(2-(4-(4-(2-Oxopyrrolidin-1-yl)phenyl)piperid
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Mol. Formula:
C27H29N7O2

M.W.:
483.58

Type:
Unknown

AlogP:
3.05

Polar Surface Area:
100.01

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4516101

Name:
8-(4-(2-(4-(3-(Pyrrolidin-1-ylmethyl)-5-(trifluoro
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Mol. Formula:
C29H32F3N7O

M.W.:
551.62

8 activity values

Type:
Unknown

AlogP:
4.54

Polar Surface Area:
82.94

HBA:
7

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4592908

Name:
8-(4-(2-(4-(3-(Pyrrolidin-1-ylmethyl)phenyl)piperi
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Mol. Formula:
C28H33N7O

M.W.:
483.62

8 activity values

Type:
Unknown

AlogP:
3.52

Polar Surface Area:
82.94

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4590283

Name:
8-(4-(2-(4-(4-(Pyridin-4-yl)phenyl)piperidin-1-yl)
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Mol. Formula:
C28H27N7O

M.W.:
477.57

Type:
Unknown

AlogP:
3.99

Polar Surface Area:
92.59

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4585876

Name:
8-(4-(2-(4-(4-(2-(Dimethylamino)ethyl)phenyl)piper
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Mol. Formula:
C27H33N7O

M.W.:
471.61

14 activity values

Type:
Unknown

AlogP:
3.03

Polar Surface Area:
82.94

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4573390

Name:
8-(4-(2-(4-(3-Chlorophenyl)-4-methylpiperidin-1-yl
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Mol. Formula:
C24H25ClN6O

M.W.:
448.96

11 activity values

Type:
Unknown

AlogP:
3.75

Polar Surface Area:
79.70

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4572027

Name:
8-(4-(2-(4-(4-(Pyridin-2-yl)phenyl)piperidin-1-yl)
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Mol. Formula:
C28H27N7O

M.W.:
477.57

Type:
Unknown

AlogP:
3.99

Polar Surface Area:
92.59

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4567766

Name:
8-(4-(2-(4-(3-(Pyridin-3-yl)phenyl)piperidin-1-yl)
Show More⌵

Mol. Formula:
C28H27N7O

M.W.:
477.57

11 activity values