Compounds

Type:
Unknown

AlogP:
2.87

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4876372

Name:
1-(1-(3-(3,5-Dichlorophenoxy)benzyl)piperidin-4-yl)-5-methylpyrimidine-2,4(Show More⌵

Mol. Formula:
C23H23Cl2N3O3

M.W.:
460.36

8 activity values

Type:
Unknown

AlogP:
4.78

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4876370

Name:
1-(1-((4-(3,5-Dichlorophenoxy)pyridin-2-yl)methyl)piperidin-4-yl)-5-methylpShow More⌵

Mol. Formula:
C22H22Cl2N4O3

M.W.:
461.35

Type:
Unknown

AlogP:
4.18

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4876042

Name:
5-Methyl-1-(1-(3-(m-tolyloxy)benzyl)piperidin-4-yl)pyrimidine-2,4(1H,3H)-diShow More⌵

Mol. Formula:
C24H27N3O3

M.W.:
405.50

Type:
Unknown

AlogP:
3.78

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4874579

Name:
1-(1-((5-(3-Chlorophenoxy)pyridin-3-yl)methyl)piperidin-4-yl)-5-methylpyrimShow More⌵

Mol. Formula:
C22H23ClN4O3

M.W.:
426.90

Type:
Unknown

AlogP:
3.52

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4873917

Name:
1-(1-(3-(3-Hydroxyphenoxy)benzyl)piperidin-4-yl)-5-methylpyrimidine-2,4(1H,Show More⌵

Mol. Formula:
C23H25N3O4

M.W.:
407.47

Type:
Unknown

AlogP:
3.18

Polar Surface Area:
87.56

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4873388

Name:
5-Methyl-1-(1-((5-phenoxypyridin-3-yl)methyl)piperidin-4-yl)pyrimidine-2,4(Show More⌵

Mol. Formula:
C22H24N4O3

M.W.:
392.46

Type:
Unknown

AlogP:
2.87

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4873321

Name:
2-((6-((4-(5-Methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl)Show More⌵

Mol. Formula:
C23H24N4O5

M.W.:
436.47

Type:
Unknown

AlogP:
2.57

Polar Surface Area:
117.52

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4872239

Name:
1-(1-((2-(3-Chlorophenoxy)pyridin-4-yl)methyl)piperidin-4-yl)-5-methylpyrimShow More⌵

Mol. Formula:
C22H23ClN4O3

M.W.:
426.90

7 activity values

Type:
Unknown

AlogP:
3.52

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4871611

Name:
1-(1-((6-(4-Hydroxyphenoxy)pyridin-2-yl)methyl)piperidin-4-yl)-5-methylpyriShow More⌵

Mol. Formula:
C22H24N4O4

M.W.:
408.46

Type:
Unknown

AlogP:
2.58

Polar Surface Area:
100.45

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4870416

Name:
5-Methyl-1-(1-((6-phenoxypyridin-2-yl)methyl)piperidin-4-yl)pyrimidine-2,4(Show More⌵

Mol. Formula:
C22H24N4O3

M.W.:
392.46

7 activity values

Type:
Unknown

AlogP:
2.87

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4869914

Name:
1-(1-((5-(3,5-Dichlorophenoxy)pyridin-3-yl)methyl)piperidin-4-yl)-5-methylpShow More⌵

Mol. Formula:
C22H22Cl2N4O3

M.W.:
461.35

Type:
Unknown

AlogP:
4.18

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4868830

Name:
5-Methyl-1-(1-(3-(3-(trifluoromethoxy)phenoxy)benzyl)piperidin-4-yl)pyrimidShow More⌵

Mol. Formula:
C24H24F3N3O4

M.W.:
475.47

Type:
Unknown

AlogP:
4.37

Polar Surface Area:
76.56

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4868671

Name:
1-(1-((4-(3-Chlorophenoxy)pyridin-2-yl)methyl)piperidin-4-yl)-5-methylpyrimShow More⌵

Mol. Formula:
C22H23ClN4O3

M.W.:
426.90

Type:
Unknown

AlogP:
3.52

Polar Surface Area:
80.22

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4865732

Name:
5-Methyl-1-(1-((5-(3-(trifluoromethoxy)phenoxy)pyridin-3-yl)methyl)piperidiShow More⌵

Mol. Formula:
C23H23F3N4O4

M.W.:
476.46

Type:
Unknown

AlogP:
3.77

Polar Surface Area:
89.45

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4864545

Name:
1-(1-(3-(Cyclohexyloxy)benzyl)piperidin-4-yl)-5-methylpyrimidine-2,4(1H,3H)Show More⌵

Mol. Formula:
C23H31N3O3

M.W.:
397.52

Type:
Unknown

AlogP:
3.39

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA4863370

Name:
1-(1-(3-(3,4-Difluorophenoxy)benzyl)piperidin-4-yl)-5-methylpyrimidine-2,4(Show More⌵

Mol. Formula:
C23H23F2N3O3

M.W.:
427.45

Type:
Unknown

AlogP:
3.75

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4861127

Name:
5-Methyl-1-(1-(3-(p-tolyloxy)benzyl)piperidin-4-yl)pyrimidine-2,4(1H,3H)-diShow More⌵

Mol. Formula:
C24H27N3O3

M.W.:
405.50

7 activity values

Type:
Unknown

AlogP:
3.78

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4860579

Name:
1-(1-(3-(3,4-Dichlorophenoxy)benzyl)piperidin-4-yl)-5-methylpyrimidine-2,4(Show More⌵

Mol. Formula:
C23H23Cl2N3O3

M.W.:
460.36

Type:
Unknown

AlogP:
4.78

Polar Surface Area:
67.33

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4860538

Name:
1-(1-((6-(3-Chlorophenoxy)pyridin-2-yl)methyl)piperidin-4-yl)-5-methylpyrimShow More⌵

Mol. Formula:
C22H23ClN4O3

M.W.:
426.90