Compounds

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ALA2158212
Name:
3-Devinyl-3-{1'-(m-iodobenzyoxy)ethyl}pyropheophor
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Mol. Formula:
C40H41IN4O4
M.W.:
768.70

27 activity values

10 unique targets
Type:
Small molecule
AlogP:
9.65
Polar Surface Area:
120.96
HBA:
5
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA2158209
Name:
3-Deacetyl-3-(10-m-iodobenzyloxyethyl)-7,8-dihydro
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Mol. Formula:
C40H41IN4O4
M.W.:
768.70

19 activity values

7 unique targets
Type:
Small molecule
AlogP:
9.65
Polar Surface Area:
120.96
HBA:
5
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA1795484
Name:
4-Acetamidophenyl 2-morpholinoacetate

Mol. Formula:
C14H18N2O4
M.W.:
278.31

2 activity values

1 unique targets
Type:
Small molecule
AlogP:
0.88
Polar Surface Area:
67.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA1795483
Name:
4-Acetamidophenyl 2-morpholinoacetate hydrochlorid
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Mol. Formula:
C14H19ClN2O4
M.W.:
314.77

2 activity values

1 unique targets
Type:
Small molecule
AlogP:
0.88
Polar Surface Area:
67.87
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA231707
Name:
2-(5-(2-(4-(dimethylamino)phenyl)ethynyl)-3-[125I]
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Mol. Formula:
C17H17IN2O2
M.W.:
406.24

37 activity values

10 unique targets
Type:
Small molecule
AlogP:
2.52
Polar Surface Area:
45.59
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE