Type:
Small moleculeAlogP:
6.39Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.47DETAILS
Type:
Small moleculeAlogP:
6.58Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
Small moleculeAlogP:
4.77Polar Surface Area:
87.15HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.43DETAILS
Type:
Small moleculeAlogP:
6.06Polar Surface Area:
58.64HBA:
4HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.49DETAILS
Type:
Small moleculeAlogP:
4.35Polar Surface Area:
60.85HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.62DETAILS-
Type:
Small moleculeAlogP:
5.38Polar Surface Area:
40.62HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
0.73Polar Surface Area:
241.41HBA:
14HBD:
8#RO5 Violations:
3#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.09DETAILS -
Type:
Small moleculeAlogP:
4.90Polar Surface Area:
40.16HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA26424
Name:
[2-(4-Benzyl-phenoxy)-ethyl]-diethyl-amineCas Number:
98774-23-3Mol. Formula:
C19H25NOM.W.:
283.41Type:
Small moleculeAlogP:
4.00Polar Surface Area:
12.47HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
5.84Polar Surface Area:
21.70HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
6.05Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
4.04Polar Surface Area:
29.54HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
5.66Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
4.90Polar Surface Area:
29.54HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
6.17Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
Small moleculeAlogP:
6.28Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
Small moleculeAlogP:
5.91Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
6.23Polar Surface Area:
21.70HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
5.52Polar Surface Area:
30.93HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.50DETAILS
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