Compounds

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ALA463716
Name:
macrocarpal J
Mol. Formula:
C28H42O7
M.W.:
490.64
13 activity values
9 unique targets
Type:
Small molecule
AlogP:
4.91
Polar Surface Area:
135.29
HBA:
7
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA462241
Name:
macrocarpal I
Mol. Formula:
C28H42O7
M.W.:
490.64
13 activity values
9 unique targets
Type:
Small molecule
AlogP:
4.91
Polar Surface Area:
135.29
HBA:
7
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA518509
Name:
macrocarpal H
Mol. Formula:
C28H40O6
M.W.:
472.62
13 activity values
9 unique targets
Type:
Small molecule
AlogP:
5.72
Polar Surface Area:
115.06
HBA:
6
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA462032
Name:
eucalyptone
Mol. Formula:
C28H38O7
M.W.:
486.61
13 activity values
9 unique targets
Type:
Small molecule
AlogP:
5.18
Polar Surface Area:
128.97
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE