Compounds

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ALA2115489
Name:
4-Amino-5-chloro-1-(2-hydroxymethyl-[1,3]dioxolan-
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Mol. Formula:
C8H10ClN3O4
M.W.:
247.64

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
-0.66
Polar Surface Area:
99.60
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA2115099
Name:
4-Amino-5-chloro-1-(2-hydroxymethyl-[1,3]dioxolan-
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Mol. Formula:
C8H10ClN3O4
M.W.:
247.64

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
-0.66
Polar Surface Area:
99.60
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA2114998
Name:
4-Amino-1-(2-hydroxymethyl-[1,3]dioxolan-4-yl)-5-i
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Mol. Formula:
C8H10IN3O4
M.W.:
339.09

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
-0.71
Polar Surface Area:
99.60
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA2114997
Name:
4-Amino-5-fluoro-1-(2-hydroxymethyl-[1,3]dioxolan-
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Mol. Formula:
C8H10FN3O4
M.W.:
231.18

4 activity values

3 unique targets
Type:
Small molecule
AlogP:
-1.17
Polar Surface Area:
99.60
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA2114995
Name:
4-Amino-5-bromo-1-(2-hydroxymethyl-[1,3]dioxolan-4
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Mol. Formula:
C8H10BrN3O4
M.W.:
292.09

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
-0.55
Polar Surface Area:
99.60
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE