Type:
Small moleculeAlogP:
2.69Polar Surface Area:
43.70HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.79DETAILS
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
23.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.85DETAILS
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
23.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.85DETAILS
ALA1202153Name:
4-Piperidin-3-yl-benzene-1,2-diol hydrobromideCas Number:
61832-52-8Mol. Formula:
C11H16BrNO2M.W.:
274.16Type:
Small moleculeAlogP:
1.56Polar Surface Area:
52.49HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.59DETAILS
Type:
Small moleculeAlogP:
5.36Polar Surface Area:
35.58HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.53DETAILS-
Type:
Small moleculeAlogP:
4.80Polar Surface Area:
44.81HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
4.00Polar Surface Area:
55.89HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
4.39Polar Surface Area:
55.89HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
3.90Polar Surface Area:
6.48HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
Small moleculeAlogP:
5.52Polar Surface Area:
44.81HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
3.85Polar Surface Area:
15.27HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.92DETAILS -
Type:
Small moleculeAlogP:
2.45Polar Surface Area:
33.12HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.71DETAILS -
Type:
Small moleculeAlogP:
2.86Polar Surface Area:
29.26HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.79DETAILS - ALA541278
Name:
3-(1-Methyl-piperidin-3-yl)-phenol hydrobromideMol. Formula:
C12H18BrNOM.W.:
272.19Type:
Small moleculeAlogP:
2.20Polar Surface Area:
23.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.74DETAILS - ALA555268
Name:
3-(1-Propyl-pyrrolidin-3-yl)-phenol hydrobromideMol. Formula:
C13H20BrNOM.W.:
286.21Type:
Small moleculeAlogP:
2.59Polar Surface Area:
23.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.82DETAILS -
Type:
Small moleculeAlogP:
2.59Polar Surface Area:
23.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.80DETAILS -
Type:
Small moleculeAlogP:
7.42Polar Surface Area:
26.79HBA:
3HBD:
---#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
Small moleculeAlogP:
5.48Polar Surface Area:
35.58HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
4.58Polar Surface Area:
35.58HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
5.34Polar Surface Area:
52.65HBA:
4HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.41DETAILS
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