Compounds

Type:
Unknown

AlogP:
2.36

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA4874630

Name:
N-[2-(2-Methyl-8,9-dihydro-7H-cyclopenta[c]pyrazolo[1,5-a]pyridin-9-yl)ethyShow More⌵

Mol. Formula:
C16H21N3O

M.W.:
271.36

4 activity values

Type:
Unknown

AlogP:
2.59

Polar Surface Area:
46.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.93

DETAILS

ALA4874010

Name:
N-[2-(2-Methyl-8,9-dihydro-7H-cyclopenta[c]pyrazolo[1,5-a]pyridin-9-yl)ethyShow More⌵

Mol. Formula:
C15H19N3O

M.W.:
257.34

Type:
Unknown

AlogP:
2.20

Polar Surface Area:
46.40

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
Y

QED Weighted:
0.92

DETAILS

ALA4873903

Name:
N-[2-(2-methoxy-7,8-dihydro-6-oxa-1,3-diaza-as-indacen-1-yl)ethyl]acetamide

Mol. Formula:
C14H17N3O3

M.W.:
275.31

83 activity values

5 unique targets

Type:
Unknown

AlogP:
1.12

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.91

DETAILS

ALA4872592

Name:
N-[2-(2-Methyl-2,6,7,8-tetrahydrocyclopenta[e]indazol-8-yl)ethyl]acetamide

Mol. Formula:
C15H19N3O

M.W.:
257.34

Type:
Unknown

AlogP:
2.13

Polar Surface Area:
46.92

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
Y

QED Weighted:
0.92

DETAILS

ALA4872217

Name:
N-[2-(2-Ethoxy-6-methoxybenzoimidazol-1-yl)ethyl]propionamide

Mol. Formula:
C15H21N3O3

M.W.:
291.35

Type:
Unknown

AlogP:
1.97

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA4870108

Name:
N-[2-(2-benzyl-7,8-dihydro-6H-indeno[5,4-d][1,3]oxazol-8-yl)ethyl]acetamide

Mol. Formula:
C21H22N2O2

M.W.:
334.42

2 activity values

Type:
Unknown

AlogP:
3.97

Polar Surface Area:
55.13

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4869463

Name:
Cyclopropanecarboxylic acid [2-(2-ethoxy-6-methoxybenzoimidazol-1-yl)ethyl]Show More⌵

Mol. Formula:
C16H21N3O3

M.W.:
303.36

Type:
Unknown

AlogP:
1.97

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA4869029

Name:
N-[2-(2-Methyl-2,6,7,8-tetrahydrocyclopenta[e]indazol-8-yl)ethyl]propionamiShow More⌵

Mol. Formula:
C16H21N3O

M.W.:
271.36

Type:
Unknown

AlogP:
2.52

Polar Surface Area:
46.92

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.93

DETAILS

ALA4868554

Name:
N-[2-(2-Methyl-7,8-dihydro-6H-indeno[5,4-d][1,3]thiazol-8-yl)ethyl]propionaShow More⌵

Mol. Formula:
C16H20N2OS

M.W.:
288.42

Type:
Unknown

AlogP:
3.55

Polar Surface Area:
41.99

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.93

DETAILS

ALA4867553

Name:
N-[2-(6-methoxy-2-methylsulfanylbenzoimidazol-1-yl)ethyl]acetamide

Mol. Formula:
C13H17N3O2S

M.W.:
279.37

Type:
Unknown

AlogP:
1.90

Polar Surface Area:
56.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA4864102

Name:
N-[2-(2-Phenyl-7,8-dihydro-6H-indeno[5,4-d][1,3]oxazol-8-yl)ethyl]acetamide

Mol. Formula:
C20H20N2O2

M.W.:
320.39

2 activity values

Type:
Unknown

AlogP:
4.05

Polar Surface Area:
55.13

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4860729

Name:
Cyclobutanecarboxylic acid [2-(2-ethoxy-6-methoxybenzoimidazol-1-yl)ethyl]aShow More⌵

Mol. Formula:
C17H23N3O3

M.W.:
317.39

Type:
Unknown

AlogP:
2.36

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA4859677

Name:
N-[2-(2-ethoxy-6-methoxybenzoimidazol-1-yl)ethyl]acetamide

Mol. Formula:
C14H19N3O3

M.W.:
277.32

Type:
Unknown

AlogP:
1.58

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ACH-000143

Name:
N-[2-(5-Chloro-2,6-dimethoxybenzoimidazol-1-yl)ethyl]acetamide

Mol. Formula:
C13H16ClN3O3

M.W.:
297.74

101 activity values

5 unique targets

Type:
Unknown

AlogP:
1.84

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.91

DETAILS

ALA4854836

Name:
N-[3-(2,6-Dimethoxybenzoimidazol-1-yl)propyl]acetamide

Mol. Formula:
C14H19N3O3

M.W.:
277.32

Type:
Unknown

AlogP:
1.58

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA4854625

Name:
N-[2-(2,6-Dimethoxybenzoimidazol-1-yl)ethyl]acetamide

Mol. Formula:
C13H17N3O3

M.W.:
263.30

Type:
Unknown

AlogP:
1.19

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.88

DETAILS

ALA4852440

Name:
N-[2-(2-Ethoxy-7,8-dihydro-6-oxa-1,3-diaza-as-indacen-1-yl)ethyl]acetamide

Mol. Formula:
C15H19N3O3

M.W.:
289.34

26 activity values

Type:
Unknown

AlogP:
1.51

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.91

DETAILS

ALA4852096

Name:
N-[2-(5-chloro-2-ethoxy-6-methoxybenzoimidazol-1-yl)ethyl]acetamide

Mol. Formula:
C14H18ClN3O3

M.W.:
311.77

38 activity values

5 unique targets

Type:
Unknown

AlogP:
2.23

Polar Surface Area:
65.38

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.89

DETAILS

ALA4848885

Name:
N-[3-(2-Ethoxy-6-methoxybenzoimidazol-1-yl)propyl]acetamide

Mol. Formula:
C15H21N3O3

M.W.:
291.35