Compounds

Type:
Small molecule

AlogP:
3.86

Polar Surface Area:
77.15

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4115351

Name:
US9351965, 74

Mol. Formula:
C27H27N7O2

M.W.:
481.56

Type:
Small molecule

AlogP:
3.78

Polar Surface Area:
121.61

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4115052

Name:
US9351965, 84

Mol. Formula:
C25H26N6O3

M.W.:
458.52

Type:
Small molecule

AlogP:
2.59

Polar Surface Area:
125.79

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4114970

Name:
US9242981, 76

Mol. Formula:
C28H31N7O2

M.W.:
497.60

Type:
Small molecule

AlogP:
4.17

Polar Surface Area:
103.18

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4114964

Name:
US9351965, 67

Mol. Formula:
C29H27F3N6O2

M.W.:
548.57

Type:
Small molecule

AlogP:
5.41

Polar Surface Area:
108.72

HBA:
6

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4114639

Name:
US9242981, 48

Mol. Formula:
C24H27FN6O

M.W.:
434.52

Type:
Small molecule

AlogP:
3.34

Polar Surface Area:
77.15

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA4114589

Name:
US9351965, 85

Mol. Formula:
C27H26N6O3

M.W.:
482.54

Type:
Small molecule

AlogP:
3.14

Polar Surface Area:
117.31

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4114558

Name:
US9351965, 90

Mol. Formula:
C28H28N6O2

M.W.:
480.57

Type:
Small molecule

AlogP:
4.39

Polar Surface Area:
108.72

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4114328

Name:
US9351965, 89

Mol. Formula:
C30H29N5O3

M.W.:
507.59

Type:
Small molecule

AlogP:
4.35

Polar Surface Area:
112.90

HBA:
6

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA4114179

Name:
US9351965, 94

Mol. Formula:
C28H28N6O2

M.W.:
480.57

Type:
Small molecule

AlogP:
4.39

Polar Surface Area:
108.72

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4114164

Name:
US9242981, 60

Mol. Formula:
C27H31N7O

M.W.:
469.59

Type:
Small molecule

AlogP:
3.70

Polar Surface Area:
82.08

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4113022

Name:
US9351965, 20

Mol. Formula:
C28H24F2N4O2S

M.W.:
518.59

Type:
Small molecule

AlogP:
5.76

Polar Surface Area:
90.90

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4112903

Name:
US9351965, 26

Mol. Formula:
C31H34FN3O4

M.W.:
531.63

Type:
Small molecule

AlogP:
5.81

Polar Surface Area:
96.47

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4112810

Name:
US9351965, 57

Mol. Formula:
C26H27N7O2

M.W.:
469.55

Type:
Small molecule

AlogP:
3.42

Polar Surface Area:
113.65

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA4112732

Name:
US9351965, 81

Mol. Formula:
C27H27N7O2

M.W.:
481.56

Type:
Small molecule

AlogP:
3.78

Polar Surface Area:
121.61

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4112353

Name:
US9351965, 62

Mol. Formula:
C30H29N7O2

M.W.:
519.61

Type:
Small molecule

AlogP:
4.57

Polar Surface Area:
113.65

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4112238

Name:
US9242981, 113

Mol. Formula:
C27H30FN7O2

M.W.:
503.58

Type:
Small molecule

AlogP:
3.60

Polar Surface Area:
90.79

HBA:
6

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4112228

Name:
US9351965, 55

Mol. Formula:
C27H26F2N4O

M.W.:
460.53

Type:
Small molecule

AlogP:
5.70

Polar Surface Area:
70.67

HBA:
3

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4111995

Name:
US9351965, 59

Mol. Formula:
C26H27N7O2

M.W.:
469.55

Type:
Small molecule

AlogP:
3.42

Polar Surface Area:
113.65

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA4111984

Name:
US9242981, 75

Mol. Formula:
C28H31N7O2

M.W.:
497.60