Compounds

Type:
Unknown

AlogP:
4.97

Polar Surface Area:
54.46

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA4800303

Name:
Cis-3-chloro-N-((1R,3S)-3-(5-(1,2-dimethyl-1H-imidazol-5-yl)-4H-1,2,4-triazShow More⌵

Mol. Formula:
C21H25ClN6O

M.W.:
412.93

Type:
Unknown

AlogP:
3.97

Polar Surface Area:
79.70

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4800028

Name:
N-methyl-N-((1R,3S)-3-(5-(4-methyl-1H-imidazol-5-yl)-4H-1,2,4-triazol-3-yl)Show More⌵

Mol. Formula:
C21H23F3N6O2

M.W.:
448.45

Type:
Unknown

AlogP:
4.20

Polar Surface Area:
99.79

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4799308

Name:
N-(3-cyanophenyl)-3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazol-1-yl)beShow More⌵

Mol. Formula:
C20H15N7O

M.W.:
369.39

Type:
Unknown

AlogP:
2.79

Polar Surface Area:
101.42

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4798431

Name:
N-(3-bromo-5-methylphenyl)-3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazoShow More⌵

Mol. Formula:
C20H17BrN6O

M.W.:
437.30

Type:
Unknown

AlogP:
3.99

Polar Surface Area:
77.63

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4797579

Name:
N-(3,4-dichlorophenyl)-6-(pyridin-4-yl)indoline-1-carboxamide

Mol. Formula:
C20H15Cl2N3O

M.W.:
384.27

Type:
Unknown

AlogP:
5.65

Polar Surface Area:
45.23

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4797569

Name:
N-(3-(dimethylamino)phenyl)-3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazShow More⌵

Mol. Formula:
C21H21N7O

M.W.:
387.45

Type:
Unknown

AlogP:
2.99

Polar Surface Area:
80.87

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4794810

Name:
Cis-3-chloro-N-((1R,3S)-3-(5-(1-(2-methoxyethyl)-4-methyl-1H-imidazol-5-yl)Show More⌵

Mol. Formula:
C23H29ClN6O2

M.W.:
456.98

Type:
Unknown

AlogP:
4.07

Polar Surface Area:
88.93

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4792959

Name:
N-(3-fluorophenyl)-7-(pyridin-4-yl)-2,3-dihydrobenzo[f][1,4]oxazepine-4(5H)Show More⌵

Mol. Formula:
C21H18FN3O2

M.W.:
363.39

Type:
Unknown

AlogP:
4.31

Polar Surface Area:
54.46

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4791903

Name:
N-(3,4-dichlorophenyl)-7-(pyridin-4-yl)-3,4-dihydroquinoline-1(2H)-carboxamShow More⌵

Mol. Formula:
C21H17Cl2N3O

M.W.:
398.29

Type:
Unknown

AlogP:
6.04

Polar Surface Area:
45.23

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4791730

Name:
N-(3-methoxyphenyl)-3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazol-1-yl)Show More⌵

Mol. Formula:
C20H18N6O2

M.W.:
374.40

Type:
Unknown

AlogP:
2.93

Polar Surface Area:
86.86

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4791131

Name:
Cis-3-chloro-N-methyl-N-((1R,3S)-3-(5-(4-methyl-1H-imidazol-5-yl)-4H-1,2,4-Show More⌵

Mol. Formula:
C20H23ClN6O

M.W.:
398.90

Type:
Unknown

AlogP:
3.96

Polar Surface Area:
90.56

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4790913

Name:
Cis-N-methyl-N-((1R,3S)-3-(5-(2-methyl-1H-imidazol-5-yl)-4H-1,2,4-triazol-3Show More⌵

Mol. Formula:
C21H23F3N6O

M.W.:
432.45

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
90.56

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA4790417

Name:
N-(3-methoxyphenyl)-7-(3-methylpyridin-4-yl)-2,3-dihydrobenzo[f][1,4]oxazepShow More⌵

Mol. Formula:
C23H23N3O3

M.W.:
389.45

Type:
Unknown

AlogP:
4.49

Polar Surface Area:
63.69

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4790120

Name:
3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazol-1-yl)-N-(3-(trifluoromethShow More⌵

Mol. Formula:
C20H15F3N6O2

M.W.:
428.37

Type:
Unknown

AlogP:
3.82

Polar Surface Area:
86.86

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4786908

Name:
N-(3-methoxyphenyl)-N-methyl-7-(pyridin-4-yl)-2,3-dihydrobenzo[f][1,4]oxazeShow More⌵

Mol. Formula:
C23H23N3O3

M.W.:
389.46

Type:
Unknown

AlogP:
4.21

Polar Surface Area:
54.90

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4785678

Name:
N-(biphenyl-3-yl)-7-(pyridin-4-yl)-2,3-dihydrobenzo[f][1,4]oxazepine-4(5H)-Show More⌵

Mol. Formula:
C27H23N3O2

M.W.:
421.50

Type:
Unknown

AlogP:
5.84

Polar Surface Area:
54.46

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4785317

Name:
3-(4-(1,4-dimethyl-1H-imidazol-5-yl)-1H-1,2,3-triazol-1-yl)-N-(3-(trifluoroShow More⌵

Mol. Formula:
C21H17F3N6O2

M.W.:
442.40

Type:
Unknown

AlogP:
4.13

Polar Surface Area:
86.86

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4784525

Name:
N-(3-(difluoromethoxy)phenyl)-3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triShow More⌵

Mol. Formula:
C20H16F2N6O2

M.W.:
410.38

Type:
Unknown

AlogP:
3.52

Polar Surface Area:
86.86

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA4784494

Name:
3-(4-(1-methyl-1H-imidazol-5-yl)-1H-1,2,3-triazol-1-yl)-N-(3-nitrophenyl)beShow More⌵

Mol. Formula:
C19H15N7O3

M.W.:
389.38