Compounds

ALA5265912

Name:
5-Fluoro-N-(4-fluoro-3-(trifluoromethyl)phenyl)-4-(1-methyl-1H-pyrazol-4-ylShow More⌵

Mol. Formula:
C15H10F5N5

M.W.:
355.27

Type:
---

AlogP:
3.92

Polar Surface Area:
55.63

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA5282209

Name:
5-Chloro-4-(1-methyl-1H-pyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Mol. Formula:
C14H11ClN6O2

M.W.:
330.74

Type:
---

AlogP:
3.18

Polar Surface Area:
98.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5281583

Name:
5-(2-amino-5-oxo-3,5-dihydro-4H-imidazol-4-ylidene)-7-chloro-3,4,5,10-tetraShow More⌵

Mol. Formula:
C15H12ClN5O2

M.W.:
329.75

Type:
---

AlogP:
1.11

Polar Surface Area:
112.37

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5281179

Name:
5-Chloro-4-(1-methyl-1H-pyrazol-4-yl)-N-(4-(methylsulfonyl)phenyl)pyrimidinShow More⌵

Mol. Formula:
C15H14ClN5O2S

M.W.:
363.83

Type:
---

AlogP:
2.68

Polar Surface Area:
89.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA5278490

Name:
5-Chloro-4-(1-methyl-1H-pyrazol-4-yl)-N-(3-((trifluoromethyl)sulfonyl)phenyShow More⌵

Mol. Formula:
C15H11ClF3N5O2S

M.W.:
417.80

Type:
---

AlogP:
3.57

Polar Surface Area:
89.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA5277565

Name:
5-Chloro-4-(1,3-dimethyl-1H-pyrazol-4-yl)-N-(1-(methylsulfonyl)piperidin-4-Show More⌵

Mol. Formula:
C15H21ClN6O2S

M.W.:
384.89

Type:
---

AlogP:
1.67

Polar Surface Area:
93.01

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.86

DETAILS

ALA5277367

Name:
5-Fluoro-4-(1-methyl-1H-pyrazol-4-yl)-N-(4-((trifluoromethyl)sulfonyl)phenyShow More⌵

Mol. Formula:
C15H11F4N5O2S

M.W.:
401.35

Type:
---

AlogP:
3.05

Polar Surface Area:
89.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA5277152

Name:
5-(2-amino-5-oxo-3,5-dihydro-4H-imidazol-4-ylidene)-7-bromo-3,4,5,10-tetrahShow More⌵

Mol. Formula:
C15H12BrN5O2

M.W.:
374.20

Type:
---

AlogP:
1.22

Polar Surface Area:
112.37

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5277074

Name:
3-((5-Chloro-4-(1-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl)amino)benzenesulfonShow More⌵

Mol. Formula:
C14H13ClN6O2S

M.W.:
364.82

Type:
---

AlogP:
1.92

Polar Surface Area:
115.79

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5273574

Name:
5-Fluoro-4-(1-methyl-1H-pyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Mol. Formula:
C14H11FN6O2

M.W.:
314.28

Type:
---

AlogP:
2.67

Polar Surface Area:
98.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5290484

Name:
5-Fluoro-4-(1-methyl-1H-pyrazol-4-yl)-N-(3-((trifluoromethyl)sulfonyl)phenyShow More⌵

Mol. Formula:
C15H11F4N5O2S

M.W.:
401.35

Type:
---

AlogP:
3.05

Polar Surface Area:
89.77

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA5287956

Name:
3-((4-Amino-6-(1-benzyl-1H-pyrazol-4-yl)pyrimidin-2-yl)amino)benzenesulfonaShow More⌵

Mol. Formula:
C20H19N7O2S

M.W.:
421.49

Type:
---

AlogP:
2.36

Polar Surface Area:
141.81

HBA:
8

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5287364

Name:
2,3,5,6-tetramethoxy-9,10-dihydrophenanthrene-1,7-diol

Mol. Formula:
C18H20O6

M.W.:
332.35

Type:
---

AlogP:
2.90

Polar Surface Area:
77.38

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.90

DETAILS

ALA5287252

Name:
3-((5-Fluoro-4-(1-methyl-1H-pyrazol-5-yl)pyrimidin-2-yl)amino)benzenesulfonShow More⌵

Mol. Formula:
C14H13FN6O2S

M.W.:
348.36

Type:
---

AlogP:
1.41

Polar Surface Area:
115.79

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA5286293

Name:
5-Fluoro-4-(1-methyl-1H-pyrazol-4-yl)-N-(1-(methylsulfonyl)piperidin-4-yl)pShow More⌵

Mol. Formula:
C14H19FN6O2S

M.W.:
354.41

Type:
---

AlogP:
0.85

Polar Surface Area:
93.01

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.88

DETAILS

ALA5286271

Name:
4-((5-Fluoro-4-(1-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl)amino)benzenesulfonShow More⌵

Mol. Formula:
C14H13FN6O2S

M.W.:
348.36

Type:
---

AlogP:
1.41

Polar Surface Area:
115.79

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA5286206

Name:
N-(3-Chloro-4-(trifluoromethyl)phenyl)-5-fluoro-4-(1-methyl-1H-pyrazol-4-ylShow More⌵

Mol. Formula:
C15H10ClF4N5

M.W.:
371.73

Type:
---

AlogP:
4.43

Polar Surface Area:
55.63

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5285766

Name:
5-(2-amino-5-oxo-3,5-dihydro-4H-imidazol-4-ylidene)-7-fluoro-3,4,5,10-tetraShow More⌵

Mol. Formula:
C15H12FN5O2

M.W.:
313.29

Type:
---

AlogP:
0.60

Polar Surface Area:
112.37

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5285541

Name:
3-((4-Amino-6-(1-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl)amino)benzenesulfonaShow More⌵

Mol. Formula:
C14H15N7O2S

M.W.:
345.39

Type:
---

AlogP:
0.85

Polar Surface Area:
141.81

HBA:
8

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5285230

Name:
5-Chloro-4-(1-methyl-1H-pyrazol-4-yl)-N-(1-(methylsulfonyl)piperidin-4-yl)pShow More⌵

Mol. Formula:
C14H19ClN6O2S

M.W.:
370.87

Type:
---

AlogP:
1.37

Polar Surface Area:
93.01

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.87

DETAILS