Compounds

ALA5267403

Name:
5-amino-N-((6-methoxypyridin-3-yl)methyl)-3,4-dimethylthieno[2,3-c]pyridaziShow More⌵

Mol. Formula:
C16H17N5O2S

M.W.:
343.41

Type:
---

AlogP:
2.22

Polar Surface Area:
103.02

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5265891

Name:
5-amino-N-(4-hydroxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamiShow More⌵

Mol. Formula:
C16H16N4O2S

M.W.:
328.40

Type:
---

AlogP:
2.53

Polar Surface Area:
101.13

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5265850

Name:
(S)-5-amino-N-(1-(3-fluoro-4-methoxyphenyl)ethyl)-3,4-dimethylthieno[2,3-c]Show More⌵

Mol. Formula:
C18H19FN4O2S

M.W.:
374.44

Type:
---

AlogP:
3.53

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5276239

Name:
5-amino-N-(2,5-difluoro-4-methoxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazinShow More⌵

Mol. Formula:
C17H16F2N4O2S

M.W.:
378.40

Type:
---

AlogP:
3.11

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5288291

Name:
5-amino-N-(2,6-difluoro-4-methoxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazinShow More⌵

Mol. Formula:
C17H16F2N4O2S

M.W.:
378.40

Type:
---

AlogP:
3.11

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5287400

Name:
7-(3-{1-[(1-fluorocyclopentyl)methyl]-1H-pyrazol-4-yl}-6-methylpyridin-2-ylShow More⌵

Mol. Formula:
C24H24FN5O

M.W.:
417.49

Type:
---

AlogP:
5.15

Polar Surface Area:
65.72

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5285036

Name:
5-amino-N-(3,5-difluoro-4-methoxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazinShow More⌵

Mol. Formula:
C17H16F2N4O2S

M.W.:
378.40

Type:
---

AlogP:
3.11

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5284390

Name:
(R)-5-amino-N-(1-(3-fluoro-4-methoxyphenyl)ethyl)-3,4-dimethylthieno[2,3-c]Show More⌵

Mol. Formula:
C18H19FN4O2S

M.W.:
374.44

Type:
---

AlogP:
3.53

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5270076

Name:
3-(6-((3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2,2-dimethylpropyl)diShow More⌵

Mol. Formula:
C36H48N4O8

M.W.:
664.80

Type:
---

AlogP:
4.53

Polar Surface Area:
72.49

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
13

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA5269998

Name:
5-amino-N-(2,3-difluoro-4-methoxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazinShow More⌵

Mol. Formula:
C17H16F2N4O2S

M.W.:
378.40

Type:
---

AlogP:
3.11

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5269733

Name:
5-amino-N-((5-fluoro-6-methoxypyridin-3-yl)methyl)-3,4-dimethylthieno[2,3-cShow More⌵

Mol. Formula:
C16H16FN5O2S

M.W.:
361.40

Type:
---

AlogP:
2.36

Polar Surface Area:
103.02

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA5268842

Name:
5-amino-N-(3-fluoro-4-(methoxy-d3)benzyl)-3,4-dimethylthieno[2,3-c]pyridaziShow More⌵

Mol. Formula:
C17H17FN4O2S

M.W.:
363.43

Type:
---

AlogP:
2.97

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5272517

Name:
5-amino-N-(2-fluoro-4-methoxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-Show More⌵

Mol. Formula:
C17H17FN4O2S

M.W.:
360.41

Type:
---

AlogP:
2.97

Polar Surface Area:
90.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5282936

Name:
5-amino-N-(3-fluoro-4-hydroxybenzyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-Show More⌵

Mol. Formula:
C16H15FN4O2S

M.W.:
346.39

Type:
---

AlogP:
2.67

Polar Surface Area:
101.13

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA5198423

Name:
(R)-6-(2-methyl-2H-indazol-5-yl)-N-((6-((tetrahydro-2H-pyran-4-yl)methyl)-6Show More⌵

Mol. Formula:
C26H34N6O

M.W.:
446.60

10 activity values

8 unique targets

Type:
---

AlogP:
3.97

Polar Surface Area:
68.10

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA5196196

Name:
6-(2-chloro-5-fluorophenyl)-N-((7-((tetrahydro-2H-pyran-4-yl)methyl)-7-azasShow More⌵

Mol. Formula:
C25H32ClFN4O

M.W.:
459.01

3 activity values

1 unique targets

Type:
---

AlogP:
5.27

Polar Surface Area:
50.28

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5205163

Name:
(R)-6-(2-chloro-5-fluorophenyl)-N-((6-(cyclohexylmethyl)-6-azaspiro[2.5]octShow More⌵

Mol. Formula:
C25H32ClFN4

M.W.:
443.01

6 activity values

2 unique targets

Type:
---

AlogP:
6.03

Polar Surface Area:
41.05

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5204478

Name:
(R)-6-(4-fluorophenyl)-N-((6-((tetrahydro-2H-pyran-4-yl)methyl)-6-azaspiro[Show More⌵

Mol. Formula:
C24H31FN4O

M.W.:
410.54

3 activity values

1 unique targets

Type:
---

AlogP:
4.22

Polar Surface Area:
50.28

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA5203077

Name:
(R)-6-(3-fluorophenyl)-N-((6-((tetrahydro-2H-pyran-4-yl)methyl)-6-azaspiro[Show More⌵

Mol. Formula:
C24H31FN4O

M.W.:
410.54

3 activity values

1 unique targets

Type:
---

AlogP:
4.22

Polar Surface Area:
50.28

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA5219691

Name:
N-(benzo[d]thiazol-5-yl)-1-((2,3-dihydrobenzofuran-5-yl)sulfonyl)piperidineShow More⌵

Mol. Formula:
C21H21N3O4S2

M.W.:
443.55

13 activity values

5 unique targets

Type:
---

AlogP:
3.27

Polar Surface Area:
88.60

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.67

DETAILS