Compounds

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ALA2144962
Name:
SID26757168
Mol. Formula:
C14H16ClN3O2
M.W.:
293.75
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.12
Polar Surface Area:
57.01
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.87
DETAILS
CLOSE
2,4,7,9-Tetramethyl-5-decyne-4,7-diol
Name:
SID26757536
Mol. Formula:
C14H26O2
M.W.:
226.36
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
2.58
Polar Surface Area:
40.46
HBA:
2
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA2137654
Name:
SID26757366
Mol. Formula:
C13H11Cl2F4N3O
M.W.:
372.15
29 activity values
17 unique targets
Type:
Small molecule
AlogP:
4.24
Polar Surface Area:
39.94
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA2136951
Name:
SID26757687
Mol. Formula:
C16H13F2N3O
M.W.:
301.30
4 activity values
3 unique targets
Type:
Small molecule
AlogP:
2.49
Polar Surface Area:
50.94
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA2136410
Name:
SID26757214
Mol. Formula:
C9H20NO3PS2
M.W.:
285.37
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
2.54
Polar Surface Area:
47.56
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA2131556
Name:
SID26757147
Mol. Formula:
C23H26O3
M.W.:
350.46
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
5.76
Polar Surface Area:
35.53
HBA:
3
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
Etofenprox
Name:
ETOFENPROX
Mol. Formula:
C25H28O3
M.W.:
376.50
51 activity values
16 unique targets
Type:
Small molecule
AlogP:
6.37
Polar Surface Area:
27.69
HBA:
3
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE