Compounds

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4-Allylanisole
Name:
Estragole
Mol. Formula:
C10H12O
M.W.:
148.20
79 activity values
29 unique targets
Type:
Small molecule
AlogP:
2.42
Polar Surface Area:
9.23
HBA:
1
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.60
DETAILS
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Linalyl Acetate
Name:
Linalyl acetate
Mol. Formula:
C12H20O2
M.W.:
196.29
53 activity values
10 unique targets
Type:
Small molecule
AlogP:
3.24
Polar Surface Area:
26.30
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
Nerol
Name:
Nerol
Mol. Formula:
C10H18O
M.W.:
154.25
74 activity values
17 unique targets
Type:
Small molecule
AlogP:
2.67
Polar Surface Area:
20.23
HBA:
1
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE