Type:
Small moleculeAlogP:
0.50Polar Surface Area:
218.05HBA:
9HBD:
7#RO5 Violations:
2#Rotatable Bonds:
20Passes Ro3:
NQED Weighted:
0.10DETAILS
Type:
Small moleculeAlogP:
-0.19Polar Surface Area:
246.73HBA:
10HBD:
8#RO5 Violations:
2#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.07DETAILS
Type:
Small moleculeAlogP:
3.23Polar Surface Area:
113.39HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS
Type:
Small moleculeAlogP:
2.36Polar Surface Area:
87.74HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.62DETAILS
ALA1627194Name:
benzyl {[amino(oxido)(2-phenylethyl)-lambda~4~-sulfanylidene]amino}acetateMol. Formula:
C17H20N2O3SM.W.:
332.43Type:
Small moleculeAlogP:
2.31Polar Surface Area:
87.74HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.62DETAILS-
Type:
Small moleculeAlogP:
0.25Polar Surface Area:
162.93HBA:
7HBD:
5#RO5 Violations:
1#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
Small moleculeAlogP:
2.51Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
1#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
156.86HBA:
6HBD:
6#RO5 Violations:
2#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
0.71Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
Small moleculeAlogP:
1.66Polar Surface Area:
162.93HBA:
7HBD:
5#RO5 Violations:
1#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
1.48Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
Small moleculeAlogP:
2.02Polar Surface Area:
104.73HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
3.15Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.18DETAILS -
Type:
Small moleculeAlogP:
1.86Polar Surface Area:
162.93HBA:
7HBD:
5#RO5 Violations:
1#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
1.73Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.23DETAILS -
Type:
Small moleculeAlogP:
1.10Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
2.12Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
Small moleculeAlogP:
1.49Polar Surface Area:
136.63HBA:
5HBD:
5#RO5 Violations:
---#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
1.98Polar Surface Area:
107.53HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
1.13Polar Surface Area:
133.83HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.32DETAILS
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