Type:
Small molecule

AlogP:
5.61

Polar Surface Area:
26.53

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.57

Type:
Small molecule

AlogP:
1.98

Polar Surface Area:
61.54

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.78

Type:
Small molecule

AlogP:
2.21

Polar Surface Area:
113.49

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.71

Type:
Small molecule

AlogP:
2.28

Polar Surface Area:
33.95

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
Y

QED Weighted:
0.60

Type:
Small molecule

AlogP:
0.62

Polar Surface Area:
77.33

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.52

Type:
Small molecule

AlogP:
1.70

Polar Surface Area:
96.57

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.51

Type:
Small molecule

AlogP:
2.29

Polar Surface Area:
72.68

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.57

Type:
Small molecule

AlogP:
3.13

Polar Surface Area:
44.47

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.60

Type:
Small molecule

AlogP:
5.25

Polar Surface Area:
83.99

HBA:
5

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.39

Type:
Small molecule

AlogP:
3.09

Polar Surface Area:
0.00

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.52

Type:
Small molecule

AlogP:
1.37

Polar Surface Area:
64.69

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.73

Type:
Small molecule

AlogP:
1.94

Polar Surface Area:
100.38

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

Type:
Small molecule

AlogP:
2.59

Polar Surface Area:
30.44

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
Y

QED Weighted:
0.58

Type:
Small molecule

AlogP:
3.90

Polar Surface Area:
54.46

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.83

Type:
Small molecule

AlogP:
2.28

Polar Surface Area:
74.95

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.57

Type:
Small molecule

AlogP:
4.59

Polar Surface Area:
17.30

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.69

Type:
Small molecule

AlogP:
1.49

Polar Surface Area:
84.73

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.70

Type:
Small molecule

AlogP:
0.55

Polar Surface Area:
63.83

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.38

Type:
Small molecule

AlogP:
-0.80

Polar Surface Area:
128.10

HBA:
8

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

Type:
Small molecule

AlogP:
2.21

Polar Surface Area:
63.16

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.64