Compounds

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ALA233839
Name:
N-(4-(4-(2-isopropoxyphenyl)piperazin-1-yl)cyclohexyl)-4-(methylsulfonyl)beShow More⌵
Mol. Formula:
C26H37N3O5S2
M.W.:
535.73

Type:
Small molecule
AlogP:
3.29
Polar Surface Area:
96.02
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
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ALA234409
Name:
3-fluoro-N-(4-(4-(2-isopropoxyphenyl)piperazin-1-yl)cyclohexyl)benzenesulfoShow More⌵
Mol. Formula:
C25H34FN3O3S
M.W.:
475.63

Type:
Small molecule
AlogP:
4.02
Polar Surface Area:
61.88
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA234408
Name:
N-(4-(4-(2-isopropoxyphenyl)piperazin-1-yl)cyclohexyl)-2-nitrobenzenesulfonShow More⌵
Mol. Formula:
C25H34N4O5S
M.W.:
502.64

Type:
Small molecule
AlogP:
3.79
Polar Surface Area:
105.02
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA234217
Name:
2-cyano-N-(4-(4-(2-isopropoxyphenyl)piperazin-1-yl)cyclohexyl)benzenesulfonShow More⌵
Mol. Formula:
C26H34N4O3S
M.W.:
482.65

Type:
Small molecule
AlogP:
3.76
Polar Surface Area:
85.67
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE