ALA4453319Name:
3-(1,1-Dioxidothiomorpholino)phenyl 4-phenylpiperidine-1-carboxylateMol. Formula:
C22H26N2O4SM.W.:
414.53Type:
UnknownAlogP:
3.30Polar Surface Area:
66.92HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS
Type:
Small moleculeAlogP:
6.10Polar Surface Area:
65.18HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.26DETAILS
Type:
Small moleculeAlogP:
6.13Polar Surface Area:
83.64HBA:
8HBD:
---#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.19DETAILS
Type:
Small moleculeAlogP:
5.27Polar Surface Area:
75.88HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS
Type:
Small moleculeAlogP:
4.41Polar Surface Area:
59.30HBA:
7HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.53DETAILS-
Type:
Small moleculeAlogP:
5.31Polar Surface Area:
64.85HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
5.13Polar Surface Area:
82.25HBA:
7HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
6.09Polar Surface Area:
65.18HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
4.55Polar Surface Area:
73.05HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
5.78Polar Surface Area:
69.89HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
6.04Polar Surface Area:
85.41HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.27DETAILS -
Type:
Small moleculeAlogP:
5.10Polar Surface Area:
70.64HBA:
7HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
4.15Polar Surface Area:
74.08HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
Small moleculeAlogP:
4.11Polar Surface Area:
79.85HBA:
7HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
3.75Polar Surface Area:
85.08HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
Small moleculeAlogP:
5.26Polar Surface Area:
56.06HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
5.79Polar Surface Area:
38.99HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
4.59Polar Surface Area:
90.20HBA:
7HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
6.04Polar Surface Area:
56.06HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
Small moleculeAlogP:
5.65Polar Surface Area:
56.06HBA:
6HBD:
---#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS
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