Compounds

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ALA2252057
Name:
2-(2,4-Dichlorophenyl)-3-[1,2,4]triazol-1-yl-propy
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Mol. Formula:
C11H12Cl2N4
M.W.:
271.15

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
2.33
Polar Surface Area:
56.73
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.93
DETAILS
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ALA2251929
Name:
[2-(2,4-Dichlorophenyl)-3-[1,2,4]triazol-1-yl-prop
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Mol. Formula:
C14H16Cl2N4
M.W.:
311.22

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
3.14
Polar Surface Area:
42.74
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA2251927
Name:
But-2-enoic Acid[2-(2,4-Dichlorophenyl)-3-[1,2,4]t
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Mol. Formula:
C15H16Cl2N4O
M.W.:
339.23

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
3.06
Polar Surface Area:
59.81
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA2251925
Name:
N-[2-(2,4-Dichlorophenyl)-3-[1,2,4]triazol-1-yl-pr
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Mol. Formula:
C13H14Cl2N4O
M.W.:
313.19

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
2.50
Polar Surface Area:
59.81
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.92
DETAILS
CLOSE
ALA2251922
Name:
Bis(4-tert-butyl-benzyl)-[2-(2,4-dichlorophenyl)-3
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Mol. Formula:
C33H40Cl2N4
M.W.:
563.62

6 activity values

6 unique targets
Type:
Small molecule
AlogP:
8.67
Polar Surface Area:
33.95
HBA:
4
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE