Type:
UnknownAlogP:
3.25Polar Surface Area:
88.77HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.48DETAILS
Type:
UnknownAlogP:
2.38Polar Surface Area:
79.82HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
UnknownAlogP:
2.62Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS
ALA4582643Name:
(3-bromophenyl)((3aS,6aS)-hexahydropyrrolo[3,4-b]pyrrol-5(1H)-yl)methanoneMol. Formula:
C13H15BrN2OM.W.:
295.18Type:
UnknownAlogP:
1.88Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.86DETAILS
Type:
UnknownAlogP:
2.27Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.86DETAILS- ALA4578411
Name:
(3-bromophenyl)((4aR,7aR)-octahydro-1H-pyrrolo[3,4-b]pyridin-1-yl)methanoneMol. Formula:
C14H17BrN2OM.W.:
309.21Type:
UnknownAlogP:
2.27Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
UnknownAlogP:
3.54Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
UnknownAlogP:
3.15Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.78DETAILS -
Type:
UnknownAlogP:
2.62Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
UnknownAlogP:
2.13Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
UnknownAlogP:
2.76Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
UnknownAlogP:
2.23Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
UnknownAlogP:
2.27Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA4551960
Name:
(3-bromophenyl)(8-methyl-1,8-diazaspiro[4.5]decan-1-yl)methanoneMol. Formula:
C16H21BrN2OM.W.:
337.26Type:
UnknownAlogP:
3.15Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA4546971
Name:
(3-bromophenyl)(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)methanoneMol. Formula:
C16H21BrN2OM.W.:
337.26Type:
UnknownAlogP:
3.15Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA4532789
Name:
(3-bromophenyl)(1-methyl-1,7-diazaspiro[4.5]decan-7-yl)methanoneMol. Formula:
C16H21BrN2OM.W.:
337.26Type:
UnknownAlogP:
3.15Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA4516859
Name:
(3-bromophenyl)(7-methyl-1,7-diazaspiro[4.5]decan-1-yl)methanoneMol. Formula:
C16H21BrN2OM.W.:
337.26Type:
UnknownAlogP:
3.15Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
UnknownAlogP:
3.68Polar Surface Area:
20.31HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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