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ALA4594209 Name:
DDD01081703
Mol. Formula:
C16H29N3O4S
M.W.:
359.49
Type:
Unknown
AlogP:
-0.16
Polar Surface Area:
70.16
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA4594204 Name:
MMV1192635
Mol. Formula:
C18H18N2O
M.W.:
278.36
Type:
Unknown
AlogP:
4.50
Polar Surface Area:
41.13
HBA:
2
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA4594203 Name:
MMV613316
Mol. Formula:
C24H19N3O2S
M.W.:
413.50
Type:
Unknown
AlogP:
5.20
Polar Surface Area:
66.28
HBA:
5
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4594191 Name:
DDD01245001
Mol. Formula:
C19H23N7
M.W.:
349.44
Type:
Unknown
AlogP:
2.10
Polar Surface Area:
62.97
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4594187 Name:
MMV1124243
Mol. Formula:
C21H21N5O3
M.W.:
391.43
Type:
Unknown
AlogP:
3.75
Polar Surface Area:
95.93
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4594186 Name:
MMV1146892
Mol. Formula:
C18H12FN3O
M.W.:
305.31
Type:
Unknown
AlogP:
4.14
Polar Surface Area:
61.80
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4594144 Name:
MMV1212722
Mol. Formula:
C21H19N3O3S
M.W.:
393.47
Type:
Unknown
AlogP:
4.13
Polar Surface Area:
76.98
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4594141 Name:
MMV1205549
Mol. Formula:
C18H16FN7OS
M.W.:
397.44
Type:
Unknown
AlogP:
3.08
Polar Surface Area:
83.02
HBA:
9
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4594121 Name:
MMV1314586
Mol. Formula:
C24H25ClN4O3S2
M.W.:
517.08
Type:
Unknown
AlogP:
4.41
Polar Surface Area:
82.17
HBA:
9
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4594114 Name:
MMV1238766
Mol. Formula:
C21H19N3O2S
M.W.:
377.47
Type:
Unknown
AlogP:
3.94
Polar Surface Area:
78.65
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4594112 Name:
MMV1239745
Mol. Formula:
C16H14N2O2S
M.W.:
298.37
Type:
Unknown
AlogP:
3.01
Polar Surface Area:
51.10
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA4594105 Name:
MMV410401
Cas Number:
791088-71-6
Mol. Formula:
C19H16Cl2N2O4S2
M.W.:
471.39
Type:
Unknown
AlogP:
4.90
Polar Surface Area:
75.71
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4594104 Name:
MMV1456246
Mol. Formula:
C29H21ClF3N3O3S
M.W.:
584.02
Type:
Unknown
AlogP:
7.16
Polar Surface Area:
66.12
HBA:
7
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA4594087 Name:
MMV1404797
Mol. Formula:
C17H12BrClN2O4S
M.W.:
455.72
Type:
Unknown
AlogP:
4.16
Polar Surface Area:
79.62
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4594085 Name:
DDD01244755
Mol. Formula:
C16H23F2N3O2S
M.W.:
359.44
Type:
Unknown
AlogP:
1.67
Polar Surface Area:
43.86
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA4594084 Name:
DDD01254278
Mol. Formula:
C18H25ClFN3O
M.W.:
353.87
Type:
Unknown
AlogP:
2.46
Polar Surface Area:
26.79
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA4594083 Name:
MMV1533246
Mol. Formula:
C9H7N3O6
M.W.:
253.17
Type:
Unknown
AlogP:
1.41
Polar Surface Area:
121.50
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4594081 Name:
MMV614518
Mol. Formula:
C25H24N4O
M.W.:
396.49
Type:
Unknown
AlogP:
5.48
Polar Surface Area:
59.81
HBA:
4
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4594069 Name:
DDD01084893
Mol. Formula:
C16H23N3O2
M.W.:
289.38
Type:
Unknown
AlogP:
1.77
Polar Surface Area:
54.46
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.92
DETAILS
CLOSE
ALA4594068 Name:
MMV1187606
Mol. Formula:
C21H16N2O4
M.W.:
360.37
Type:
Unknown
AlogP:
3.44
Polar Surface Area:
70.83
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
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