Compounds

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ALA3577210
Name:
preacredinone A
Mol. Formula:
C20H22O7
M.W.:
374.39
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.02
Polar Surface Area:
91.29
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.59
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ALA3577209
Name:
acredinone B
Mol. Formula:
C36H36O11
M.W.:
644.67
26 activity values
12 unique targets
Type:
Small molecule
AlogP:
5.65
Polar Surface Area:
147.05
HBA:
11
HBD:
2
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
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ALA3577208
Name:
acredinone A
Mol. Formula:
C36H34O10
M.W.:
626.66
41 activity values
13 unique targets
Type:
Small molecule
AlogP:
6.15
Polar Surface Area:
129.98
HBA:
10
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE