Compounds

ALA4800541

Name:
(1s,4s)-4-[1-methyl-2-[[3-(trifluoromethyl)phenyl]methyl]benzimidazol-5-yl]Show More⌵

Mol. Formula:
C23H23F3N2O3

M.W.:
432.44

2 activity values

2 unique targets

Type:
Unknown

AlogP:
5.21

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4800499

Name:
(1s,4s)-4-[(2-phenyl-1,3-benzoxazol-5-yl)oxy]cyclohexanecarboxylic acid

Mol. Formula:
C20H19NO4

M.W.:
337.38

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.52

Polar Surface Area:
72.56

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA4797544

Name:
(1s,4s)-4-[1-methyl-2-(m-tolylmethyl)imidazo[4,5-b]pyridin-5-yl]oxycyclohexShow More⌵

Mol. Formula:
C22H25N3O3

M.W.:
379.46

2 activity values

2 unique targets

Type:
Unknown

AlogP:
3.89

Polar Surface Area:
77.24

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4791698

Name:
(1s,4s)-4-[1-methyl-2-(m-tolylmethoxy)benzimidazol-5-yl]oxycyclohexanecarboShow More⌵

Mol. Formula:
C23H26N2O4

M.W.:
394.47

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.48

Polar Surface Area:
73.58

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4787809

Name:
(1s,4s)-4-[3-cyano-1-methyl-2-(m-tolylmethyl)indol-5-yl]oxycyclohexanecarboShow More⌵

Mol. Formula:
C25H26N2O3

M.W.:
402.49

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.97

Polar Surface Area:
75.25

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4787746

Name:
(1s,4s)-4-[7-chloro-1-methyl-2-(m-tolylmethyl)benzimidazol-5-yl]oxycyclohexShow More⌵

Mol. Formula:
C23H25ClN2O3

M.W.:
412.92

2 activity values

2 unique targets

Type:
Unknown

AlogP:
5.15

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4785177

Name:
(1s,4s)-4-[3-methyl-2-(m-tolylmethyl)benzimidazol-5-yl]oxycyclohexanecarboxShow More⌵

Mol. Formula:
C23H26N2O3

M.W.:
378.47

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.49

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA4783346

Name:
(1s,4s)-4-[1-methyl-2-(p-tolylmethyl)benzimidazol-5-yl]oxycyclohexanecarboxShow More⌵

Mol. Formula:
C23H26N2O3

M.W.:
378.47

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.49

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA4781788

Name:
(1s,4s)-4-[[2-(m-tolylmethyl)-1,3-benzoxazol-5-yl]oxy]cyclohexanecarboxylicShow More⌵

Mol. Formula:
C22H23NO4

M.W.:
365.43

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.75

Polar Surface Area:
72.56

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA4764916

Name:
(1r,4r)-2-(2,3-dihydrobenzofuran-6-ylmethyl)-5-[4-fluoro-4-(1H-tetrazol-5-yShow More⌵

Mol. Formula:
C24H25FN6O2

M.W.:
448.50

2 activity values

2 unique targets

Type:
Unknown

AlogP:
3.80

Polar Surface Area:
90.74

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4761105

Name:
(1s,4s)-4-[1-isopropyl-2-(m-tolylmethyl)benzimidazol-5-yl]oxycyclohexanecarShow More⌵

Mol. Formula:
C25H30N2O3

M.W.:
406.53

2 activity values

2 unique targets

Type:
Unknown

AlogP:
5.54

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4757057

Name:
(1s,4s)-4-[1-methyl-2-(m-tolylmethyl)indol-5-yl]oxycyclohexanecarboxylic acShow More⌵

Mol. Formula:
C24H27NO3

M.W.:
377.48

2 activity values

2 unique targets

Type:
Unknown

AlogP:
5.10

Polar Surface Area:
51.46

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4755109

Name:
(1s,4s)-4-[3-methyl-2-(m-tolylmethyl)indazol-6-yl]oxycyclohexanecarboxylic Show More⌵

Mol. Formula:
C23H26N2O3

M.W.:
378.47

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.72

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4754540

Name:
(1s,4s)-4-[3-methyl-2-(m-tolylmethyl)imidazo[4,5-c]pyridin-6-yl]oxycyclohexShow More⌵

Mol. Formula:
C22H25N3O3

M.W.:
379.46

2 activity values

2 unique targets

Type:
Unknown

AlogP:
3.89

Polar Surface Area:
77.24

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4752206

Name:
(1s,4s)-4-[1-methyl-2-(o-tolylmethyl)benzimidazol-5-yl]oxycyclohexanecarboxShow More⌵

Mol. Formula:
C23H26N2O3

M.W.:
378.47

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.49

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA4751045

Name:
(1s,4s)-4-[1-methyl-2-(m-tolylmethyl)benzimidazol-5-yl]oxycyclohexanecarboxShow More⌵

Mol. Formula:
C23H27N3O2

M.W.:
377.49

2 activity values

2 unique targets

Type:
Unknown

AlogP:
3.90

Polar Surface Area:
70.14

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4750346

Name:
(1r,4r)-5-[4-fluoro-4-(1H-tetrazol-5-yl)cyclohexoxy]-1-methyl-2-(m-tolylmetShow More⌵

Mol. Formula:
C23H25FN6O

M.W.:
420.49

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.17

Polar Surface Area:
81.51

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4749130

Name:
(1s,4s)-1-methyl-2-(m-tolylmethyl)-5-[4-(1H-tetrazol-5-yl)cyclohexoxy]benziShow More⌵

Mol. Formula:
C23H26N6O

M.W.:
402.50

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.09

Polar Surface Area:
81.51

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4748671

Name:
(1s,4s)-3-[4-[1-methyl-2-(m-tolylmethyl)benzimidazol-5-yl]oxycyclohexyl]-4HShow More⌵

Mol. Formula:
C24H26N4O3

M.W.:
418.50

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.25

Polar Surface Area:
85.94

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4748493

Name:
(1s,4s)-4-[3-carbamoyl-1-methyl-2-(m-tolylmethyl)indol-5-yl]oxycyclohexanecShow More⌵

Mol. Formula:
C25H28N2O4

M.W.:
420.51

2 activity values

2 unique targets

Type:
Unknown

AlogP:
4.20

Polar Surface Area:
94.55

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS