Compounds

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ALA487799
Name:
Pallidisetin B
Mol. Formula:
C23H18O3
M.W.:
342.39
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
4.96
Polar Surface Area:
46.53
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA519724
Name:
Pallidisetin A
Mol. Formula:
C23H18O3
M.W.:
342.39
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
4.96
Polar Surface Area:
46.53
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA374083
Name:
EF24-Phe-Phe-Arg-chloromethyl ketone trifluoroacetic acid salt
Mol. Formula:
C50H49ClF5N7O9
M.W.:
1022.42
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.27
Polar Surface Area:
220.72
HBA:
8
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
20
Passes Ro3:
N
QED Weighted:
0.01
DETAILS
CLOSE
ALA379849
Name:
3,5-bis(2-fluorobenzylidene)piperidin-4-one
Mol. Formula:
C19H15F2NO
M.W.:
311.33
182 activity values
51 unique targets
Type:
Small molecule
AlogP:
3.60
Polar Surface Area:
29.10
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE