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ALA4559282 Name:
(2-adamantylideneamino) 3-(3,4,5-trimethoxyphenyl)
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Mol. Formula:
C22H27NO5
M.W.:
385.46
Type:
Unknown
AlogP:
4.08
Polar Surface Area:
66.35
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4745160 Name:
(S,Z)-N-(1-bromo-1-(3-(2-(diethylamino)ethoxy)phen
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Mol. Formula:
C31H36BrN3O4
M.W.:
594.55
Type:
Unknown
AlogP:
4.62
Polar Surface Area:
90.90
HBA:
5
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA4742753 Name:
N-[(Z)-1-[[(1S)-1-benzyl-2-hydroxy-ethyl]carbamoyl
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Mol. Formula:
C25H21BrClFN2O3
M.W.:
531.81
Type:
Unknown
AlogP:
4.69
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4742126 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H21BrCl2N2O3
M.W.:
548.26
Type:
Unknown
AlogP:
5.21
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4763858 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C26H25BrN2O4
M.W.:
509.40
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
87.66
HBA:
4
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4763319 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H22BrClN2O3
M.W.:
513.82
Type:
Unknown
AlogP:
4.55
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4763228 Name:
(S,Z)-3-bromo-N-(1-bromo-3-((1-hydroxy-3-phenylpro
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Mol. Formula:
C25H22Br2N2O3
M.W.:
558.27
Type:
Unknown
AlogP:
4.66
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4762709 Name:
(S,Z)-2-bromo-N-(1-bromo-3-((1-hydroxy-3-phenylpro
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Mol. Formula:
C25H22Br2N2O3
M.W.:
558.27
Type:
Unknown
AlogP:
4.66
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4762386 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C26H25BrN2O4
M.W.:
509.40
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
87.66
HBA:
4
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4761302 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H22BrClN2O3
M.W.:
513.82
Type:
Unknown
AlogP:
4.55
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4760740 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H21BrF2N2O3
M.W.:
515.35
Type:
Unknown
AlogP:
4.18
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4760443 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C26H24BrFN2O3
M.W.:
511.39
Type:
Unknown
AlogP:
4.35
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4760093 Name:
(R)-9-(2-(3-(but-3-ynyl)-3H-diazirin-3-yl)ethoxy)-
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Mol. Formula:
C26H27N3O6
M.W.:
477.52
Type:
Unknown
AlogP:
4.10
Polar Surface Area:
119.55
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4759656 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H22BrN3O5
M.W.:
524.37
Type:
Unknown
AlogP:
3.81
Polar Surface Area:
121.57
HBA:
5
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4757555 Name:
(S,Z)-N-(1-bromo-1-(3-bromophenyl)-3-((1-hydroxy-3
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Mol. Formula:
C25H22Br2N2O3
M.W.:
558.27
Type:
Unknown
AlogP:
4.66
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.35
DETAILS
CLOSE
ALA4756799 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C26H25BrN2O3
M.W.:
493.40
Type:
Unknown
AlogP:
4.21
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4756381 Name:
(S)-9-(2-(3-(but-3-ynyl)-3H-diazirin-3-yl)ethoxy)-
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Mol. Formula:
C26H27N3O6
M.W.:
477.52
Type:
Unknown
AlogP:
4.10
Polar Surface Area:
119.55
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4756329 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C25H22BrFN2O3
M.W.:
497.36
Type:
Unknown
AlogP:
4.04
Polar Surface Area:
78.43
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4780181 Name:
2-(benzylthio)-6-(2-(dimethylamino)ethoxy)-3-(fura
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Mol. Formula:
C24H25N3O3S
M.W.:
435.55
Type:
Unknown
AlogP:
4.27
Polar Surface Area:
60.50
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4780094 Name:
(S,Z)-N-(1-bromo-3-((1-hydroxy-3-phenylpropan-2-yl
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Mol. Formula:
C26H25BrN2O4
M.W.:
509.40
Type:
Unknown
AlogP:
3.91
Polar Surface Area:
87.66
HBA:
4
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
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