Compounds

Type:
Unknown

AlogP:
3.50

Polar Surface Area:
154.69

HBA:
10

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4790916

Name:
1-(3-methoxyphenyl)-N-(2,3,6-trifluoro-4-(2-((3S,5S)-5-fluoropiperidin-3-ylShow More⌵

Mol. Formula:
C29H30F4N6O4S

M.W.:
634.66

Type:
Unknown

AlogP:
4.52

Polar Surface Area:
127.24

HBA:
9

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA4789787

Name:
1-(2-cyano-4-methylphenyl)-N-(2-fluoro-4-(2-((3S,5S)-5-fluoropiperidin-3-ylShow More⌵

Mol. Formula:
C29H30F2N8O3S

M.W.:
608.68

Type:
Unknown

AlogP:
3.81

Polar Surface Area:
154.69

HBA:
10

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4777304

Name:
N-(4-(2-((1r,4r)-4-(dimethylamino)cyclohexylamino)-8-isopropyl-7-oxo-7,8-diShow More⌵

Mol. Formula:
C31H35F3N6O3S

M.W.:
628.72

Type:
Unknown

AlogP:
5.68

Polar Surface Area:
109.22

HBA:
8

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4757194

Name:
N-(2-fluoro-4-(8-isopropyl-2-((1r,4r)-4-((2-methoxyethyl)(methyl)amino)cyclShow More⌵

Mol. Formula:
C33H40F2N6O4S

M.W.:
654.78

Type:
Unknown

AlogP:
5.56

Polar Surface Area:
118.45

HBA:
9

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4748828

Name:
N-(4-(2-((1r,4r)-4-(dimethylamino)cyclohexylamino)-8-isopropyl-7-oxo-7,8-diShow More⌵

Mol. Formula:
C28H34F5N7O3S

M.W.:
643.68

Type:
Unknown

AlogP:
5.08

Polar Surface Area:
122.11

HBA:
9

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4588737

Name:
6-chloro-3-(6-fluoro-2-(phenylamino)-1H-benzo[d]imidazol-5-yl)-N-((1-methylShow More⌵

Mol. Formula:
C26H26ClFN8

M.W.:
505.00

12 activity values

3 unique targets

Type:
Unknown

AlogP:
5.56

Polar Surface Area:
86.17

HBA:
7

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4585763

Name:
6-chloro-N-(cyclopropylmethyl)-3-(2-(phenylamino)-1H-benzo[d]imidazol-5-yl)Show More⌵

Mol. Formula:
C23H20ClN7

M.W.:
429.92

5 activity values

2 unique targets

Type:
Unknown

AlogP:
5.49

Polar Surface Area:
82.93

HBA:
6

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA4576760

Name:
6-Chloro-N-(cyclopropylmethyl)-3-(1H-benzo[d]imidazol-5-yl)-imidazo[1,2-b]pShow More⌵

Mol. Formula:
C17H15ClN6

M.W.:
338.80

Type:
Unknown

AlogP:
3.75

Polar Surface Area:
70.90

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4576457

Name:
N-(trans-4-((6-Chloro-3-(1H-indazol-5-yl)imidazo[1,2-b]-pyridazin-8-yl)aminShow More⌵

Mol. Formula:
C21H22ClN7O

M.W.:
423.91

Type:
Unknown

AlogP:
3.79

Polar Surface Area:
100.00

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4568715

Name:
6-chloro-3-(1H-indazol-5-yl)-N-((1-methylpiperidin-4-yl)methyl)imidazo[1,2-Show More⌵

Mol. Formula:
C20H22ClN7

M.W.:
395.90

Type:
Unknown

AlogP:
3.68

Polar Surface Area:
74.14

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4568597

Name:
6-chloro-N-(cyclopropylmethyl)-3-(1-methyl-2-(phenylamino)-1H-benzo[d]imidaShow More⌵

Mol. Formula:
C24H22ClN7

M.W.:
443.94

Type:
Unknown

AlogP:
5.50

Polar Surface Area:
72.07

HBA:
7

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4566731

Name:
6-chloro-N-(cyclopropylmethyl)-3-(2-(methyl(phenyl)amino)-1H-benzo[d]imidazShow More⌵

Mol. Formula:
C24H22ClN7

M.W.:
443.94

Type:
Unknown

AlogP:
5.52

Polar Surface Area:
74.14

HBA:
6

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4565193

Name:
2-(((1r,4r)-4-((6-Chloro-3-(1H-indazol-5-yl)imidazo[1,2-b]-pyridazin-8-yl)aShow More⌵

Mol. Formula:
C25H29ClN8O2

M.W.:
509.01

39 activity values

19 unique targets

Type:
Unknown

AlogP:
3.10

Polar Surface Area:
112.47

HBA:
8

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA4554474

Name:
4-(6-(isopropylamino)imidazo[1,2-b]pyridazin-3-yl)-2-methoxybenzamide

Mol. Formula:
C17H19N5O2

M.W.:
325.37

Type:
Unknown

AlogP:
2.32

Polar Surface Area:
94.54

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4551799

Name:
(1r,4r)-N1-(6-chloro-3-(1H-indazol-5-yl)imidazo[1,2-b]pyridazin-8-yl)-N1-meShow More⌵

Mol. Formula:
C20H22ClN7

M.W.:
395.90

Type:
Unknown

AlogP:
3.63

Polar Surface Area:
88.13

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4538288

Name:
6-chloro-3-(4-fluoro-2-(phenylamino)-1H-benzo[d]imidazol-5-yl)-N-((1-methylShow More⌵

Mol. Formula:
C26H26ClFN8

M.W.:
505.00

Type:
Unknown

AlogP:
5.56

Polar Surface Area:
86.17

HBA:
7

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4534769

Name:
6-Chloro-3-(1H-indazol-5-yl)-N-(trans-4-morpholinocyclohexyl)-imidazo[1,2-bShow More⌵

Mol. Formula:
C24H28ClN7O

M.W.:
465.99