Compounds

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ALA394158
Name:
(1R,2S,3R,5R)-methyl 3-(4-ethynylphenyl)-8-aza-bicyclo[3.2.1]octane-2-carboShow More⌵
Mol. Formula:
C17H19NO2
M.W.:
269.34
5 activity values
5 unique targets
Type:
Small molecule
AlogP:
2.06
Polar Surface Area:
38.33
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.66
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ALA210126
Name:
1-(2-(2-ethylphenyl)-1-phenylethyl)piperazine
Mol. Formula:
C20H26N2
M.W.:
294.44
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.44
Polar Surface Area:
15.27
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.91
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ALA210028
Name:
1-(1-phenyl-2-o-tolylethyl)piperazine
Mol. Formula:
C19H24N2
M.W.:
280.42
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.18
Polar Surface Area:
15.27
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.93
DETAILS
CLOSE