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ALA3210910 Name:
SID49820236
Mol. Formula:
C20H24FN9O2
M.W.:
441.47
Type:
Small molecule
AlogP:
1.90
Polar Surface Area:
140.35
HBA:
10
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA1522307 Name:
SID24809900
Mol. Formula:
C17H12N2O
M.W.:
260.30
Type:
Small molecule
AlogP:
3.25
Polar Surface Area:
44.10
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA1459861 Name:
SID22414542
Mol. Formula:
C16H27NO3
M.W.:
281.40
Type:
Small molecule
AlogP:
2.77
Polar Surface Area:
57.61
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.85
DETAILS
CLOSE
ALA1447326 Name:
SID49736858
Mol. Formula:
C23H28N2O5
M.W.:
412.49
Type:
Small molecule
AlogP:
2.88
Polar Surface Area:
77.10
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA1443623 Name:
SID24796942
Mol. Formula:
C29H33N7
M.W.:
479.63
Type:
Small molecule
AlogP:
4.68
Polar Surface Area:
62.97
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA1423844 Name:
SID14719192
Mol. Formula:
C10H11ClN4S
M.W.:
254.75
Type:
Small molecule
AlogP:
2.79
Polar Surface Area:
53.60
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA1367787 Name:
SID24807071
Mol. Formula:
C26H24N4O4
M.W.:
456.50
Type:
Small molecule
AlogP:
3.78
Polar Surface Area:
97.56
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA1320481 Name:
SID49666145
Mol. Formula:
C18H12FNO4S
M.W.:
357.36
Type:
Small molecule
AlogP:
4.63
Polar Surface Area:
75.63
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
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