Compounds

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ALA3113606
Name:
[11C]-N-Pyridin-[4-ylmethyl-3-[4-[2-(4-methoxyphen
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Mol. Formula:
C28H34N4O3
M.W.:
473.61

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
3.60
Polar Surface Area:
66.93
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA404980
Name:
(S)-(+)-1-(1-[11C]methyl-1H-pyrrol-2-yl)-2-phenyl-
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Mol. Formula:
C17H20N2O
M.W.:
267.36

5 activity values

1 unique targets
Type:
Small molecule
AlogP:
3.04
Polar Surface Area:
25.24
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA270484
Name:
(R)-(-)-1-(1-[11C]methyl-1H-pyrrol-2-yl)-2-phenyl-
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Mol. Formula:
C17H20N2O
M.W.:
267.36

5 activity values

1 unique targets
Type:
Small molecule
AlogP:
3.04
Polar Surface Area:
25.24
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA229494
Name:
(3S,12aS)-3-methyl-2,3,6,7,12,12a-hexahydropyrazin
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Mol. Formula:
C15H15N3O2
M.W.:
269.30

5 activity values

3 unique targets
Type:
Small molecule
AlogP:
0.94
Polar Surface Area:
65.20
HBA:
2
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE