Type:
UnknownAlogP:
6.66Polar Surface Area:
87.80HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
UnknownAlogP:
4.17Polar Surface Area:
55.11HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS
Type:
UnknownAlogP:
3.44Polar Surface Area:
94.34HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS
Type:
UnknownAlogP:
4.13Polar Surface Area:
79.60HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
4.15Polar Surface Area:
94.34HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.47DETAILS-
Type:
UnknownAlogP:
4.28Polar Surface Area:
55.11HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
4.17Polar Surface Area:
55.11HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
UnknownAlogP:
3.40Polar Surface Area:
55.11HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
UnknownAlogP:
6.55Polar Surface Area:
35.76HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
UnknownAlogP:
6.29Polar Surface Area:
56.51HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
UnknownAlogP:
6.58Polar Surface Area:
36.28HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
UnknownAlogP:
6.94Polar Surface Area:
35.76HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
---AlogP:
3.90Polar Surface Area:
71.42HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
2.14Polar Surface Area:
112.65HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
1.36Polar Surface Area:
112.65HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
1.02Polar Surface Area:
95.58HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA4086143
Name:
3-(5-Fluoro-1H-indol-3-yl)pyrrolidine-2,5-dioneCas Number:
198474-05-4Mol. Formula:
C12H9FN2O2M.W.:
232.21Type:
Small moleculeAlogP:
1.44Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
1.02Polar Surface Area:
95.58HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
0.47Polar Surface Area:
103.85HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
Small moleculeAlogP:
1.02Polar Surface Area:
95.58HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.77DETAILS
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