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ALA4556242 Name:
5-(5-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)py
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Mol. Formula:
C23H27ClN2O2
M.W.:
398.93
Type:
Unknown
AlogP:
3.85
Polar Surface Area:
54.38
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA5202162 Name:
Mol. Formula:
C132H202N48O38S6
M.W.:
3261.77
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5180704 Name:
Mol. Formula:
C168H256N52O66S4
M.W.:
4188.46
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5176133 Name:
Mol. Formula:
C141H217N53O39S8
M.W.:
3535.15
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5170487 Name:
Mol. Formula:
C126H198N42O38S4
M.W.:
3037.49
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4559380 Name:
3-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)-5-ph
Show More⌵
Mol. Formula:
C24H25ClN2O
M.W.:
392.93
Type:
Unknown
AlogP:
5.39
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4551353 Name:
5-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)pyrim
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Mol. Formula:
C17H20ClN3O
M.W.:
317.82
Type:
Unknown
AlogP:
3.12
Polar Surface Area:
47.04
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.92
DETAILS
CLOSE
ALA4537917 Name:
2-bromo-5-((3-(3-chlorobenzyl)piperidin-3-yl)metho
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Mol. Formula:
C18H20BrClN2O
M.W.:
395.73
Type:
Unknown
AlogP:
4.49
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.76
DETAILS
CLOSE
ALA4537587 Name:
3-bromo-5-((3-(3-chlorobenzyl)piperidin-3-yl)metho
Show More⌵
Mol. Formula:
C18H20BrClN2O
M.W.:
395.73
Type:
Unknown
AlogP:
4.49
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA4533711 Name:
4-(5-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)py
Show More⌵
Mol. Formula:
C22H25ClN2O2
M.W.:
384.91
Type:
Unknown
AlogP:
3.46
Polar Surface Area:
54.38
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA4541936 Name:
4-(5-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)py
Show More⌵
Mol. Formula:
C22H25ClN2O2
M.W.:
384.91
Type:
Unknown
AlogP:
3.46
Polar Surface Area:
54.38
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA4520291 Name:
2-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)pyrid
Show More⌵
Mol. Formula:
C18H21ClN2O
M.W.:
316.83
Type:
Unknown
AlogP:
3.73
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA4579917 Name:
4-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)pyrid
Show More⌵
Mol. Formula:
C18H21ClN2O
M.W.:
316.83
Type:
Unknown
AlogP:
3.73
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.91
DETAILS
CLOSE
ALA4450187 Name:
2-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)-9H-c
Show More⌵
Mol. Formula:
C25H25ClN2O
M.W.:
404.94
Type:
Unknown
AlogP:
5.97
Polar Surface Area:
37.05
HBA:
2
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4440256 Name:
3-((3-(3,4-dichlorobenzyl)piperidin-3-yl)methoxy)p
Show More⌵
Mol. Formula:
C18H20Cl2N2O
M.W.:
351.28
Type:
Unknown
AlogP:
4.38
Polar Surface Area:
34.15
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.87
DETAILS
CLOSE
ALA4436100 Name:
5-(5-((3-(3-chlorobenzyl)piperidin-3-yl)methoxy)py
Show More⌵
Mol. Formula:
C23H27ClN2O2
M.W.:
398.93
Type:
Unknown
AlogP:
3.85
Polar Surface Area:
54.38
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA3219578 Name:
(1R,5S)-3-(2-(2-chlorophenyl)hydrazono)-8-methyl-8
Show More⌵
Mol. Formula:
C14H18ClN3
M.W.:
263.77
Type:
Small molecule
AlogP:
3.36
Polar Surface Area:
27.63
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA3219577 Name:
4-(2-(2,5-difluorophenyl)hydrazono)-1-phenethylpip
Show More⌵
Mol. Formula:
C19H21F2N3
M.W.:
329.39
Type:
Small molecule
AlogP:
4.07
Polar Surface Area:
27.63
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA1947206 Name:
endo-(1R,5S)-8-(3-hydroxyphenethyl)-8-azabicyclo[3
Show More⌵
Mol. Formula:
C22H25NO3
M.W.:
351.45
Type:
Small molecule
AlogP:
3.79
Polar Surface Area:
49.77
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA1947205 Name:
exo-(1R,5S)-8-(2-(3,5-dihydroxyphenyl)-2-hydroxyet
Show More⌵
Mol. Formula:
C22H25NO5
M.W.:
383.44
Type:
Small molecule
AlogP:
2.98
Polar Surface Area:
90.23
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
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