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ALA2028068 Name:
MMV667492
Mol. Formula:
C17H19N3O3
M.W.:
313.36
Type:
Small molecule
AlogP:
2.81
Polar Surface Area:
78.84
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA2028067 Name:
MMV667490
Mol. Formula:
C29H27N5O3
M.W.:
493.57
Type:
Small molecule
AlogP:
5.11
Polar Surface Area:
87.18
HBA:
8
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA2028066 Name:
MMV667489
Mol. Formula:
C24H20ClNO2
M.W.:
389.88
Type:
Small molecule
AlogP:
6.11
Polar Surface Area:
38.33
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA2028064 Name:
MMV403679
Mol. Formula:
C25H19N7O3
M.W.:
465.47
Type:
Small molecule
AlogP:
4.32
Polar Surface Area:
123.89
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA2028063 Name:
MMV396794
Mol. Formula:
C17H27Cl2NO2
M.W.:
348.31
Type:
Small molecule
AlogP:
4.54
Polar Surface Area:
41.49
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA2028062 Name:
MMV396770
Mol. Formula:
C19H24N6O
M.W.:
352.44
Type:
Small molecule
AlogP:
2.43
Polar Surface Area:
73.39
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA2028061 Name:
MMV396744
Mol. Formula:
C23H24FN5O
M.W.:
405.48
Type:
Small molecule
AlogP:
3.93
Polar Surface Area:
85.83
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA2028060 Name:
MMV396726
Mol. Formula:
C32H28N4O
M.W.:
484.60
Type:
Small molecule
AlogP:
6.20
Polar Surface Area:
56.30
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA2028059 Name:
MMV396719
Mol. Formula:
C22H19N3O
M.W.:
341.41
Type:
Small molecule
AlogP:
4.86
Polar Surface Area:
39.08
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA2028058 Name:
MMV396717
Mol. Formula:
C27H23ClFN3O3
M.W.:
491.95
Type:
Small molecule
AlogP:
5.68
Polar Surface Area:
78.45
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA2028057 Name:
MMV396715
Mol. Formula:
C21H17N3
M.W.:
311.39
Type:
Small molecule
AlogP:
4.85
Polar Surface Area:
29.85
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA2028056 Name:
MMV396704
Mol. Formula:
C15H16ClN5
M.W.:
301.78
Type:
Small molecule
AlogP:
2.52
Polar Surface Area:
48.05
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA2028055 Name:
MMV396703
Mol. Formula:
C16H20ClN5
M.W.:
317.82
Type:
Small molecule
AlogP:
3.52
Polar Surface Area:
56.84
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA2028054 Name:
MMV396681
Mol. Formula:
C22H15F3N4O3S
M.W.:
472.45
Type:
Small molecule
AlogP:
5.30
Polar Surface Area:
78.27
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA2028053 Name:
MMV396680
Mol. Formula:
C22H16ClF3N4OS
M.W.:
476.91
Type:
Small molecule
AlogP:
6.11
Polar Surface Area:
59.29
HBA:
5
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA2028052 Name:
MMV396679
Mol. Formula:
C22H16ClF3N4O2S
M.W.:
492.91
Type:
Small molecule
AlogP:
5.81
Polar Surface Area:
68.52
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA2028051 Name:
MMV396672
Mol. Formula:
C20H23F3N2OS
M.W.:
396.48
Type:
Small molecule
AlogP:
5.11
Polar Surface Area:
32.34
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA2028050 Name:
MMV396669
Mol. Formula:
C24H27N5O
M.W.:
401.51
Type:
Small molecule
AlogP:
4.70
Polar Surface Area:
70.15
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA2028049 Name:
MMV396665
Mol. Formula:
C23H20N2O4S
M.W.:
420.49
Type:
Small molecule
AlogP:
4.83
Polar Surface Area:
69.68
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA2028048 Name:
MMV396664
Mol. Formula:
C28H27NO7
M.W.:
489.52
Type:
Small molecule
AlogP:
5.36
Polar Surface Area:
85.22
HBA:
8
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
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