Compounds

Type:
Unknown

AlogP:
4.62

Polar Surface Area:
46.92

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4799904

Name:
3-(4-(2'-Fluoro-5'-methoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)benzShow More⌵

Mol. Formula:
C22H16FN3O3

M.W.:
389.39

6 activity values

Type:
Unknown

AlogP:
4.45

Polar Surface Area:
77.24

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4794288

Name:
3-(4-(2',3'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

6 activity values

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4792757

Name:
4-(1-(2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-3-fluoroShow More⌵

Mol. Formula:
C21H17FN4O2

M.W.:
376.39

Type:
Unknown

AlogP:
4.15

Polar Surface Area:
62.06

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4792422

Name:
3-((4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)phenyl)carbamoyl)-benzoic Acid

Mol. Formula:
C22H17NO5

M.W.:
375.38

4 activity values

Type:
Unknown

AlogP:
4.08

Polar Surface Area:
84.86

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4791850

Name:
3-(4-(4-(2,3-Dihydrobenzo[b][1,4]dioxin-5-yl)phenyl)-1H-1,2,3-triazol-1-yl)Show More⌵

Mol. Formula:
C23H17N3O4

M.W.:
399.41

Type:
Unknown

AlogP:
4.07

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4791002

Name:
3-(1-(2',4'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4789318

Name:
2-(1-(2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-pyridine

Mol. Formula:
C21H18N4O2

M.W.:
358.40

Type:
Unknown

AlogP:
4.01

Polar Surface Area:
62.06

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4787568

Name:
3-(1-(2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-pyridine

Mol. Formula:
C21H18N4O2

M.W.:
358.40

Type:
Unknown

AlogP:
4.01

Polar Surface Area:
62.06

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4784772

Name:
3-(4-(2'-Methoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)-benzoic Acid

Mol. Formula:
C22H17N3O3

M.W.:
371.40

Type:
Unknown

AlogP:
4.31

Polar Surface Area:
77.24

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4783519

Name:
Methyl 4-(4-(2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)piShow More⌵

Mol. Formula:
C23H20N4O4

M.W.:
416.44

Type:
Unknown

AlogP:
3.80

Polar Surface Area:
88.36

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4783039

Name:
3-(1-(3'-Hydroxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Acid

Mol. Formula:
C21H15N3O3

M.W.:
357.37

Type:
Unknown

AlogP:
4.01

Polar Surface Area:
88.24

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4780317

Name:
3-(1-(3',4'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4780000

Name:
3-(1-(3',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

8 activity values

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4779996

Name:
3-(4-(3',4'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4776746

Name:
3-(4-(4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)phenyl)-1H-1,2,3-triazol-1-yl)Show More⌵

Mol. Formula:
C23H17N3O4

M.W.:
399.41

2 activity values

Type:
Unknown

AlogP:
4.07

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4762947

Name:
3-(1-(2',6'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4761985

Name:
3-(4-(2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-1-yl)-pyridine

Mol. Formula:
C21H18N4O2

M.W.:
358.40

Type:
Unknown

AlogP:
4.01

Polar Surface Area:
62.06

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4761656

Name:
3-(1-(2',3'-Dimethoxy-[1,1'-biphenyl]-4-yl)-1H-1,2,3-triazol-4-yl)-benzoic Show More⌵

Mol. Formula:
C23H19N3O4

M.W.:
401.42

20 activity values

4 unique targets

Type:
Unknown

AlogP:
4.32

Polar Surface Area:
86.47

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4760568

Name:
3-(4-(4-(Benzo[d][1,3]dioxol-5-yl)phenyl)-1H-1,2,3-triazol-1-yl)-benzoic AcShow More⌵

Mol. Formula:
C22H15N3O4

M.W.:
385.38