Compounds

ALA5272132

Name:
N-(2-(5-methoxyisoindolin-2-yl)-5-methylpyrimidin-4-yl)-1H-indazol-5-amine

Mol. Formula:
C21H20N6O

M.W.:
372.43

Type:
---

AlogP:
3.93

Polar Surface Area:
78.96

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5270382

Name:
4-(4-((2-aminopyrimidin-4-yl)amino)-2,6-difluorophenoxy)-1H-pyrrolo[2,3-b]pShow More⌵

Mol. Formula:
C18H11F2N7O

M.W.:
379.33

Type:
---

AlogP:
3.62

Polar Surface Area:
125.53

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA5269818

Name:
N-(3-methoxybenzyl)-6-(1H-pyrazol-4-yl)-1H-benzo[d]imidazole-2-carboxamide

Mol. Formula:
C19H17N5O2

M.W.:
347.38

Type:
---

AlogP:
2.89

Polar Surface Area:
95.69

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5269663

Name:
N-(2-(dimethylamino)ethyl)-N-(3-methoxybenzyl)-6-(1H-pyrazol-4-yl)-1H-indazShow More⌵

Mol. Formula:
C23H26N6O2

M.W.:
418.50

Type:
---

AlogP:
3.17

Polar Surface Area:
90.14

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5282451

Name:
1-((4-(1H-pyrazol-4-yl)phenyl)(4-chlorophenyl)methyl)piperazine

Mol. Formula:
C20H21ClN4

M.W.:
352.87

Type:
---

AlogP:
3.72

Polar Surface Area:
43.95

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5281966

Name:
N-(4-(1H-pyrazol-4-yl)phenyl)-2-(5-methoxyisoindolin-2-yl)pyrimidin-4-amine

Mol. Formula:
C22H20N6O

M.W.:
384.44

Type:
---

AlogP:
4.14

Polar Surface Area:
78.96

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5281803

Name:
2-(5-methoxyisoindolin-2-yl)-N-(4-(pyridin-4-yl)phenyl)pyrimidin-4-amine

Mol. Formula:
C24H21N5O

M.W.:
395.47

Type:
---

AlogP:
4.81

Polar Surface Area:
63.17

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5281208

Name:
(tetrahydrofuran-2-yl)methyl 3-((3-((1H-indazol-5-yl)amino)piperidin-1-yl)mShow More⌵

Mol. Formula:
C25H30N4O3

M.W.:
434.54

Type:
---

AlogP:
3.98

Polar Surface Area:
79.48

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA5281033

Name:
N-(4-(1H-pyrazol-4-yl)-2-(2-(pyrrolidin-1-yl)ethoxy)phenyl)-2-(2-chlorophenShow More⌵

Mol. Formula:
C23H25ClN4O2

M.W.:
424.93

Type:
---

AlogP:
4.39

Polar Surface Area:
70.25

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5280099

Name:
3-(4-(1H-pyrazol-4-yl)phenyl)-3-(3-chlorophenoxy)-N-methylpropan-1-amine

Mol. Formula:
C19H20ClN3O

M.W.:
341.84

Type:
---

AlogP:
4.46

Polar Surface Area:
49.94

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5279379

Name:
3-((4-(5-methyl-1H-tetrazol-1-yl)benzamido)methyl)-N-(5-methyl-3a,4,5,6,7,7Show More⌵

Mol. Formula:
C24H26N8O2S

M.W.:
490.59

Type:
---

AlogP:
1.81

Polar Surface Area:
117.40

HBA:
9

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5278707

Name:
5-fluoro-N-(4-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)phenyl)isoindolinShow More⌵

Mol. Formula:
C23H21FN4O2

M.W.:
404.45

Type:
---

AlogP:
4.00

Polar Surface Area:
78.09

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA5278333

Name:
N-(3-methoxybenzyl)-5-(1H-pyrazol-4-yl)-1H-indole-2-carboxamide

Mol. Formula:
C20H18N4O2

M.W.:
346.39

Type:
---

AlogP:
3.50

Polar Surface Area:
82.80

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5278094

Name:
(S)-2-(4-(1H-pyrazol-4-yl)phenyl)-2-(4-chlorophenyl)-N-methylethan-1-amine

Mol. Formula:
C18H18ClN3

M.W.:
311.82

Type:
---

AlogP:
4.08

Polar Surface Area:
40.71

HBA:
2

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5276748

Name:
(R)-4-methyl-5-((2-methyl-1,4-diazepan-1-yl)thio)isoquinoline dihydrochloriShow More⌵

Mol. Formula:
C16H23Cl2N3S

M.W.:
360.35

Type:
---

AlogP:
3.23

Polar Surface Area:
28.16

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.86

DETAILS

ALA5274003

Name:
N4-(4-((1H-pyrrolo[2,3-b]pyridin-4-yl)oxy)-3-fluorophenyl)-6-(pyridin-4-yl)Show More⌵

Mol. Formula:
C22H16FN7O

M.W.:
413.42

Type:
---

AlogP:
4.67

Polar Surface Area:
114.63

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA5273210

Name:
5-chloro-N-(4-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)phenyl)isoindolinShow More⌵

Mol. Formula:
C23H21ClN4O2

M.W.:
420.90

Type:
---

AlogP:
4.52

Polar Surface Area:
78.09

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5284365

Name:
N-(3-methoxybenzyl)-1-methyl-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide

Mol. Formula:
C20H19N5O2

M.W.:
361.40

Type:
---

AlogP:
2.90

Polar Surface Area:
84.83

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA5284291

Name:
4-(((1r,4r)-4-aminocyclohexyl)amino)-2,5-difluorobenzamide

Mol. Formula:
C13H17F2N3O

M.W.:
269.30

Type:
---

AlogP:
1.75

Polar Surface Area:
81.14

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA5283983

Name:
N-(2-(5-methoxyisoindolin-2-yl)pyrimidin-4-yl)-1H-indazol-5-amine

Mol. Formula:
C20H18N6O

M.W.:
358.41

Type:
---

AlogP:
3.63

Polar Surface Area:
78.96

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS