Type:
---AlogP:
4.35Polar Surface Area:
214.12HBA:
11HBD:
6#RO5 Violations:
3#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.04DETAILS
ALA3125879Name:
Ethyl 2-(2-(cyclohexanecarboxamido)-6-morpholino-9Hpurin-9-yl)acetateMol. Formula:
C20H28N6O4M.W.:
416.48Type:
Small moleculeAlogP:
1.74Polar Surface Area:
111.47HBA:
9HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.71DETAILS
Type:
Small moleculeAlogP:
5.75Polar Surface Area:
134.30HBA:
10HBD:
1#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.15DETAILS
Type:
Small moleculeAlogP:
5.25Polar Surface Area:
107.10HBA:
9HBD:
2#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.29DETAILS
ALA3125695Name:
Ethyl 2-(2-((4-cyclohexylbenzyl)amino)-6-morpholino-9H-purin-9-yl)acetateMol. Formula:
C26H34N6O3M.W.:
478.60Type:
Small moleculeAlogP:
3.89Polar Surface Area:
94.40HBA:
9HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.49DETAILS-
Type:
Small moleculeAlogP:
5.51Polar Surface Area:
93.96HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
Small moleculeAlogP:
5.12Polar Surface Area:
93.96HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
5.40Polar Surface Area:
93.96HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
4.76Polar Surface Area:
133.40HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.21DETAILS -
Type:
Small moleculeAlogP:
3.39Polar Surface Area:
120.70HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.33DETAILS -
Type:
Small moleculeAlogP:
5.01Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
4.62Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
4.90Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
2.27Polar Surface Area:
137.77HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
Small moleculeAlogP:
6.28Polar Surface Area:
160.60HBA:
12HBD:
1#RO5 Violations:
3#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.09DETAILS -
Type:
Small moleculeAlogP:
5.78Polar Surface Area:
133.40HBA:
11HBD:
2#RO5 Violations:
3#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
4.41Polar Surface Area:
120.70HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
Small moleculeAlogP:
6.03Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
Small moleculeAlogP:
5.64Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.23DETAILS -
Type:
Small moleculeAlogP:
5.93Polar Surface Area:
120.26HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.23DETAILS
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