Type:
Small molecule

AlogP:
1.70

Polar Surface Area:
132.96

HBA:
6

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.44

Type:
Small molecule

AlogP:
0.41

Polar Surface Area:
151.42

HBA:
8

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.37

Type:
Small molecule

AlogP:
6.05

Polar Surface Area:
46.76

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.40

Type:
Small molecule

AlogP:
6.54

Polar Surface Area:
17.30

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.35

Type:
Small molecule

AlogP:
6.07

Polar Surface Area:
30.44

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.39

Type:
Small molecule

AlogP:
5.87

Polar Surface Area:
30.19

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.40

Type:
Small molecule

AlogP:
6.61

Polar Surface Area:
17.30

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.34

Type:
Small molecule

AlogP:
7.13

Polar Surface Area:
17.30

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.32

Type:
Small molecule

AlogP:
6.48

Polar Surface Area:
26.53

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.35

Type:
Small molecule

AlogP:
6.48

Polar Surface Area:
26.53

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.35

Type:
Small molecule

AlogP:
7.47

Polar Surface Area:
39.42

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.27

Type:
Small molecule

AlogP:
7.69

Polar Surface Area:
17.30

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.30

Type:
Small molecule

AlogP:
6.40

Polar Surface Area:
17.30

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.37

Type:
Small molecule

AlogP:
7.60

Polar Surface Area:
30.19

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.28

Type:
Small molecule

AlogP:
6.68

Polar Surface Area:
43.33

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.34

Type:
Small molecule

AlogP:
-3.07

Polar Surface Area:
342.20

HBA:
20

HBD:
8

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.06

Type:
Small molecule

AlogP:
5.42

Polar Surface Area:
42.23

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.53

Type:
Small molecule

AlogP:
8.50

Polar Surface Area:
101.65

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.19

Type:
Small molecule

AlogP:
9.46

Polar Surface Area:
64.35

HBA:
4

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.21

Type:
Small molecule

AlogP:
8.68

Polar Surface Area:
88.14

HBA:
5

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.21