Type:
Small moleculeAlogP:
2.31Polar Surface Area:
37.83HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS
Type:
Small moleculeAlogP:
2.62Polar Surface Area:
45.17HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.93DETAILS
Type:
Small moleculeAlogP:
2.93Polar Surface Area:
34.17HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.84DETAILS
ALA1923417Name:
1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-(4-[18F]fluorobenzyl)piperazineMol. Formula:
C19H21FN2O2M.W.:
327.39Type:
Small moleculeAlogP:
2.92Polar Surface Area:
24.94HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.86DETAILS
ALA219179Name:
6-(4-((1H-benzo[d]imidazol-2-yl)methyl)piperazin-1-yl)pyridin-3-olMol. Formula:
C17H19N5OM.W.:
309.37Type:
Small moleculeAlogP:
1.99Polar Surface Area:
68.28HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS- ALA28997
Name:
3-[4-(4-Fluoro-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C18H19FN4M.W.:
310.38Type:
Small moleculeAlogP:
3.02Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS - ALA28607
Name:
3-[4-(4-Methoxy-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C19H22N4OM.W.:
322.41Type:
Small moleculeAlogP:
2.89Polar Surface Area:
44.39HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS -
Type:
Small moleculeAlogP:
3.61Polar Surface Area:
35.16HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
Small moleculeAlogP:
3.90Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA29808
Name:
3-[4-(4-Vinyl-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C20H22N4M.W.:
318.42Type:
Small moleculeAlogP:
3.53Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA435949
Name:
3-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C19H22N4OM.W.:
322.41Type:
Small moleculeAlogP:
2.89Polar Surface Area:
44.39HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA282829
Name:
3-[4-(4-Ethyl-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C20H24N4M.W.:
320.44Type:
Small moleculeAlogP:
3.45Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA28833
Name:
3-[4-(4-Propyl-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C21H26N4M.W.:
334.47Type:
Small moleculeAlogP:
3.84Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA287671
Name:
3-(4-Biphenyl-4-yl-piperazin-1-ylmethyl)-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C24H24N4M.W.:
368.48Type:
Small moleculeAlogP:
4.55Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA282424
Name:
3-[4-(2-Fluoro-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridineMol. Formula:
C18H19FN4M.W.:
310.38Type:
Small moleculeAlogP:
3.02Polar Surface Area:
35.16HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS
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