Compounds

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ALA3596263
Name:
2alpha-Hydroxy-Stachybotrylactone
Mol. Formula:
C23H30O6
M.W.:
402.49
5 activity values
5 unique targets
Type:
Small molecule
AlogP:
2.94
Polar Surface Area:
96.22
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.58
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ALA3596261
Name:
(S)-5-((3R,5R,8R,9S,10S,13R,14S,17R)-17-((R)-4-carboxybutan-2-yl)-10,13-dimShow More⌵
Mol. Formula:
C35H48N4O9
M.W.:
668.79
7 activity values
5 unique targets
Type:
Small molecule
AlogP:
6.85
Polar Surface Area:
194.99
HBA:
10
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.12
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ALA3596260
Name:
4-(1-((R)-4-((3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecaShow More⌵
Mol. Formula:
C30H49N3O3
M.W.:
499.74
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
6.12
Polar Surface Area:
88.24
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
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ALA3596256
Name:
NH2-GNWWWW
Mol. Formula:
C50H51N11O8
M.W.:
934.03
1 activity values
1 unique targets
Type:
Protein
AlogP:
2.23
Polar Surface Area:
315.07
HBA:
8
HBD:
12
#RO5 Violations:
2
#Rotatable Bonds:
21
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
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