Type:
---AlogP:
-0.08Polar Surface Area:
88.66HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.54DETAILS
Type:
---AlogP:
0.54Polar Surface Area:
76.13HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
---AlogP:
0.08Polar Surface Area:
79.37HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.57DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
---AlogP:
0.60Polar Surface Area:
76.13HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.40DETAILS-
Type:
---AlogP:
0.68Polar Surface Area:
76.13HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
---AlogP:
5.74Polar Surface Area:
101.01HBA:
6HBD:
3#RO5 Violations:
2#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
---AlogP:
6.53Polar Surface Area:
88.62HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
---AlogP:
8.17Polar Surface Area:
123.27HBA:
7HBD:
2#RO5 Violations:
2#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.23DETAILS - ALA4634392
Name:
3-[(4-bromophenyl)methoxy]-5-isobutyl-imidazolidine-2,4-dioneMol. Formula:
C14H17BrN2O3M.W.:
341.21Type:
UnknownAlogP:
2.85Polar Surface Area:
58.64HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.84DETAILS - ALA4633768
Name:
3-[(3-chlorophenyl)methoxy]-5-isobutyl-imidazolidine-2,4-dioneMol. Formula:
C14H17ClN2O3M.W.:
296.75Type:
UnknownAlogP:
2.74Polar Surface Area:
58.64HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.85DETAILS - ALA4632826
Name:
3-[(3-chlorophenyl)methoxy]-5-isopropyl-imidazolidine-2,4-dioneMol. Formula:
C13H15ClN2O3M.W.:
282.73Type:
UnknownAlogP:
2.35Polar Surface Area:
58.64HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
UnknownAlogP:
4.72Polar Surface Area:
41.99HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
7.47Polar Surface Area:
136.83HBA:
9HBD:
---#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.11DETAILS - ALA4294756
Name:
Ethyl 4-(bis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxalin-3-ylthio)butan-oateMol. Formula:
C16H16N6O2SM.W.:
356.41Type:
Small moleculeAlogP:
2.36Polar Surface Area:
86.68HBA:
9HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
Small moleculeAlogP:
7.61Polar Surface Area:
113.69HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
5.86Polar Surface Area:
110.53HBA:
7HBD:
---#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
Small moleculeAlogP:
6.74Polar Surface Area:
76.39HBA:
5HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS - ALA4291398
Name:
Bis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline-3-thiolMol. Formula:
C10H6N6SM.W.:
242.27Type:
Small moleculeAlogP:
1.21Polar Surface Area:
60.38HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.47DETAILS
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