Compounds

Type:
Unknown

AlogP:
4.55

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA4872571

Name:
N-(6-((1-cyclopropylpiperidin-4-ylidene)fluoromethyl)pyridin-2-yl)-2,4,6-trShow More⌵

Mol. Formula:
C21H19F4N3O

M.W.:
405.40

Type:
Unknown

AlogP:
4.69

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4871295

Name:
N-(6-((1-(difluoromethyl)piperidin-4-ylidene)fluoromethyl)pyridin-2-yl)-2,4Show More⌵

Mol. Formula:
C19H15F6N3O

M.W.:
415.34

Type:
Unknown

AlogP:
4.75

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4865700

Name:
4-chloro-2-fluoro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2Show More⌵

Mol. Formula:
C19H18ClF2N3O

M.W.:
377.82

Type:
Unknown

AlogP:
4.53

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA4862526

Name:
4-chloro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yl)benzaShow More⌵

Mol. Formula:
C19H19ClFN3O

M.W.:
359.83

Type:
Unknown

AlogP:
4.39

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.88

DETAILS

ALA4861949

Name:
2,4,6-trifluoro-N-(6-(fluoro(1-(trifluoromethyl)piperidin-4-ylidene)methyl)Show More⌵

Mol. Formula:
C19H14F7N3O

M.W.:
433.33

Type:
Unknown

AlogP:
5.05

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4860576

Name:
5-fluoro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yl)picolShow More⌵

Mol. Formula:
C18H18F2N4O

M.W.:
344.37

10 activity values

Type:
Unknown

AlogP:
3.27

Polar Surface Area:
58.12

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.93

DETAILS

ALA4852743

Name:
5-chloro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yl)picolShow More⌵

Mol. Formula:
C18H18ClFN4O

M.W.:
360.82

Type:
Unknown

AlogP:
3.79

Polar Surface Area:
58.12

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.90

DETAILS

ALA4851044

Name:
2,4,6-trifluoro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yShow More⌵

Mol. Formula:
C19H17F4N3O

M.W.:
379.36

46 activity values

12 unique targets

Type:
Unknown

AlogP:
4.16

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.82

DETAILS

ALA4847626

Name:
2,4-difluoro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yl)bShow More⌵

Mol. Formula:
C19H18F3N3O

M.W.:
361.37

Type:
Unknown

AlogP:
4.02

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.90

DETAILS

ALA4846825

Name:
4-fluoro-N-(6-(fluoro(1-methylpiperidin-4-ylidene)methyl)pyridin-2-yl)benzaShow More⌵

Mol. Formula:
C19H19F2N3O

M.W.:
343.38

Type:
Unknown

AlogP:
3.88

Polar Surface Area:
45.23

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.92

DETAILS

ALA3617560

Name:
4-fluoro-N-(4-(1-methylpiperidine-4-carbonyl)pyridin-2-yl)benzamide

Mol. Formula:
C19H20FN3O2

M.W.:
341.39

Type:
Small molecule

AlogP:
3.00

Polar Surface Area:
62.30

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA3617559

Name:
4-fluoro-N-(5-(1-methylpiperidine-4-carbonyl)pyridin-3-yl)benzamide

Mol. Formula:
C19H20FN3O2

M.W.:
341.39

5 unique targets

Type:
Small molecule

AlogP:
3.00

Polar Surface Area:
62.30

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA3617557

Name:
4-fluoro-N-(6-(1-methylpiperidine-4-carbonyl)pyridin-2-yl)benzamide

Mol. Formula:
C19H20FN3O2

M.W.:
341.39

8 activity values

5 unique targets

Type:
Small molecule

AlogP:
3.00

Polar Surface Area:
62.30

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA3616488

Name:
4-fluoro-N-(2-methoxy-3-(1-methylpiperidine-4-carbonyl)phenyl)benzamide

Mol. Formula:
C21H23FN2O3

M.W.:
370.42

Type:
Small molecule

AlogP:
3.61

Polar Surface Area:
58.64

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.82

DETAILS

ALA3617554

Name:
N-(2-chloro-3-(1-methylpiperidine-4-carbonyl)phenyl)-4-fluorobenzamide

Mol. Formula:
C20H20ClFN2O2

M.W.:
374.84

Type:
Small molecule

AlogP:
4.26

Polar Surface Area:
49.41

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA186951

Name:
2-Chloro-4-fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydro-1H-benzoimidazShow More⌵

Mol. Formula:
C20H22ClFN4O

M.W.:
388.87

Type:
Small molecule

AlogP:
4.02

Polar Surface Area:
47.61

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA187308

Name:
2-Chloro-4-fluoro-N-[3-(1-methyl-piperidin-4-yl)-benzo[d]isoxazol-5-yl]-benShow More⌵

Mol. Formula:
C20H19ClFN3O2

M.W.:
387.84

Type:
Small molecule

AlogP:
4.68

Polar Surface Area:
58.37

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA186662

Name:
2,4-Difluoro-N-[3-(1-methyl-piperidin-4-yl)-benzo[d]isoxazol-5-yl]-benzamidShow More⌵

Mol. Formula:
C20H19F2N3O2

M.W.:
371.39

Type:
Small molecule

AlogP:
4.17

Polar Surface Area:
58.37

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA361303

Name:
4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indol-6-yl]-benzamide

Mol. Formula:
C21H22FN3O

M.W.:
351.42