Type:
Small molecule

AlogP:
3.11

Polar Surface Area:
103.37

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.39

Type:
Small molecule

AlogP:
2.47

Polar Surface Area:
165.50

HBA:
8

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.25

Type:
Small molecule

AlogP:
3.06

Polar Surface Area:
165.50

HBA:
8

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.17

Type:
Small molecule

AlogP:
0.59

Polar Surface Area:
164.78

HBA:
9

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.40

Type:
Small molecule

AlogP:
1.29

Polar Surface Area:
66.12

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.73

Type:
Small molecule

AlogP:
4.00

Polar Surface Area:
59.27

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.57

Type:
Small molecule

AlogP:
0.50

Polar Surface Area:
113.76

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.48

Type:
Small molecule

AlogP:
4.32

Polar Surface Area:
79.30

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

Type:
Small molecule

AlogP:
3.91

Polar Surface Area:
64.63

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

Type:
Small molecule

AlogP:
-0.25

Polar Surface Area:
285.20

HBA:
21

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
27

Passes Ro3:
N

QED Weighted:
0.05

Type:
Small molecule

AlogP:
1.85

Polar Surface Area:
85.94

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.91

Type:
Small molecule

AlogP:
6.00

Polar Surface Area:
75.19

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.26

Type:
Small molecule

AlogP:
5.81

Polar Surface Area:
101.30

HBA:
8

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.18

Type:
Small molecule

AlogP:
1.40

Polar Surface Area:
116.19

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.67

Type:
Small molecule

AlogP:
5.02

Polar Surface Area:
81.69

HBA:
6

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.46

Type:
Small molecule

AlogP:
2.05

Polar Surface Area:
112.66

HBA:
8

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.44

Type:
Small molecule

AlogP:
3.49

Polar Surface Area:
101.93

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.47

Type:
Small molecule

AlogP:
3.03

Polar Surface Area:
102.68

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.72

Type:
Small molecule

AlogP:
1.95

Polar Surface Area:
112.66

HBA:
8

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.48

Type:
Small molecule

AlogP:
3.92

Polar Surface Area:
62.98

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.61