Compounds

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ALA454066
Name:
(S)-((S)-3-(hepta-1,3,5-trienyl)-7-methyl-6,8-dioxo-7,8-dihydro-6H-isochromShow More⌵
Mol. Formula:
C21H22O6
M.W.:
370.40
28 activity values
13 unique targets
Type:
Small molecule
AlogP:
2.62
Polar Surface Area:
89.90
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
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ALA454065
Name:
(3S)-((7S)-3-(hepta-1,3,5-trienyl)-7-methyl-6,8-dioxo-1a,6,7,8-tetrahydrooxShow More⌵
Mol. Formula:
C21H22O7
M.W.:
386.40
28 activity values
13 unique targets
Type:
Small molecule
AlogP:
1.84
Polar Surface Area:
102.43
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE