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ALA3137549 Name:
Mol. Formula:
C22H16ClF2N5O2
M.W.:
455.85
Type:
Small molecule
AlogP:
4.46
Polar Surface Area:
81.41
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA3137665 Name:
Mol. Formula:
C20H14F2N6O2
M.W.:
408.37
Type:
Small molecule
AlogP:
4.07
Polar Surface Area:
79.36
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA3137664 Name:
Mol. Formula:
C24H20F2N4O3
M.W.:
450.45
Type:
Small molecule
AlogP:
5.76
Polar Surface Area:
70.77
HBA:
7
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA3137663 Name:
Mol. Formula:
C20H13F2N5O3
M.W.:
409.35
Type:
Small molecule
AlogP:
4.63
Polar Surface Area:
87.57
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3137662 Name:
Mol. Formula:
C22H12F5N5O2
M.W.:
473.36
Type:
Small molecule
AlogP:
5.75
Polar Surface Area:
74.43
HBA:
7
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA3137661 Name:
Mol. Formula:
C24H17F4N5O3
M.W.:
499.42
Type:
Small molecule
AlogP:
4.16
Polar Surface Area:
81.85
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3137660 Name:
Mol. Formula:
C21H15F2N5O2
M.W.:
407.38
Type:
Small molecule
AlogP:
4.68
Polar Surface Area:
66.47
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3137659 Name:
Mol. Formula:
C24H17F4N5O3
M.W.:
499.42
Type:
Small molecule
AlogP:
4.16
Polar Surface Area:
81.85
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3137658 Name:
Mol. Formula:
C24H19F4N5O2
M.W.:
485.44
Type:
Small molecule
AlogP:
4.64
Polar Surface Area:
64.78
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA3137657 Name:
Mol. Formula:
C22H15Cl2FN6O
M.W.:
469.31
Type:
Small molecule
AlogP:
5.83
Polar Surface Area:
70.13
HBA:
7
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA3137656 Name:
Mol. Formula:
C20H16F3N5O
M.W.:
399.38
Type:
Small molecule
AlogP:
4.19
Polar Surface Area:
64.34
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA3137655 Name:
Mol. Formula:
C18H10F4N4O2
M.W.:
390.30
Type:
Small molecule
AlogP:
4.46
Polar Surface Area:
61.54
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA3137654 Name:
Mol. Formula:
C18H11F7N4O2S
M.W.:
480.37
Type:
Small molecule
AlogP:
6.84
Polar Surface Area:
61.54
HBA:
6
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3137653 Name:
Mol. Formula:
C18H14F4N6O
M.W.:
406.34
Type:
Small molecule
AlogP:
3.67
Polar Surface Area:
70.13
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA3137652 Name:
Mol. Formula:
C22H14F4N6O
M.W.:
454.39
Type:
Small molecule
AlogP:
4.45
Polar Surface Area:
70.13
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA3137651 Name:
Mol. Formula:
C21H13ClF5N5O2
M.W.:
497.81
Type:
Small molecule
AlogP:
4.99
Polar Surface Area:
81.41
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA3137650 Name:
Mol. Formula:
C20H13Cl2F2N5O2
M.W.:
464.26
Type:
Small molecule
AlogP:
4.63
Polar Surface Area:
81.41
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA3137649 Name:
Mol. Formula:
C18H11F4N5O
M.W.:
389.31
Type:
Small molecule
AlogP:
4.41
Polar Surface Area:
64.34
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA3137648 Name:
Mol. Formula:
C19H11ClF3N5O2
M.W.:
433.78
Type:
Small molecule
AlogP:
4.44
Polar Surface Area:
81.41
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA3137647 Name:
Mol. Formula:
C21H12F4N6O
M.W.:
440.36
Type:
Small molecule
AlogP:
4.52
Polar Surface Area:
70.13
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
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