Compounds

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ALA2398290
Name:
3-(5-((2-(benzo[d]thiazol-2-yl)hydrazono)methyl)furan-2-yl)-2-methylbenzoicShow More⌵
Mol. Formula:
C20H15N3O3S
M.W.:
377.43

Type:
Small molecule
AlogP:
5.01
Polar Surface Area:
87.72
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
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ALA521253
Name:
Biphenyl-4-carboxylic acid {[4-(adamantan-1-ylamino)-3-nitro-phenylcarbamoyShow More⌵
Mol. Formula:
C32H34N4O4
M.W.:
538.65
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
6.35
Polar Surface Area:
104.58
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
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ALA481480
Name:
Biphenyl-4-carboxylic acid methyl-[(3-nitro-4-piperidin-1-yl-phenylcarbamoyShow More⌵
Mol. Formula:
C27H28N4O4
M.W.:
472.55
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
4.96
Polar Surface Area:
95.79
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA521427
Name:
biphenyl-4-carboxylic acid methyl-[(3-nitro-4-thiomorpholin-4-yl-phenyl-carShow More⌵
Mol. Formula:
C26H26N4O4S
M.W.:
490.59
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
4.53
Polar Surface Area:
95.79
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE