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ALA4476273 Name:
3-(4-hydroxybenzyl)-6-(4-hydroxyphenethyl)-2,2-dim
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Mol. Formula:
C22H27NO3
M.W.:
353.46
Type:
Unknown
AlogP:
3.60
Polar Surface Area:
69.56
HBA:
4
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4537499 Name:
4,6-dimethyl-5-(m-chlorophenyl)-2-[(4-phenyl-1-pip
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Mol. Formula:
C25H25ClN4O2
M.W.:
448.95
Type:
Unknown
AlogP:
4.12
Polar Surface Area:
48.79
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4537150 Name:
4,6-dimethyl-5-phenyl-2-{[4-(o-ethoxyphenyl)-1-pip
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Mol. Formula:
C27H30N4O3
M.W.:
458.56
Type:
Unknown
AlogP:
3.87
Polar Surface Area:
58.02
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4536976 Name:
6-(2-(Pyridin-3-yl)ethenyl)-4,5-dihydropyridazin-3
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Mol. Formula:
C11H11N3O
M.W.:
201.23
Type:
Unknown
AlogP:
1.36
Polar Surface Area:
54.35
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.79
DETAILS
CLOSE
ALA4532877 Name:
N-[4-cyano-1-(4-sulfamoylphenyl)-1H-pyrazol-5-yl]-
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Mol. Formula:
C16H18N6O4S
M.W.:
390.43
Type:
Unknown
AlogP:
-0.34
Polar Surface Area:
143.34
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4531165 Name:
2-Chloro-N-[4-cyano-1-(4-sulfamoylphenyl)-1H-pyraz
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Mol. Formula:
C12H10ClN5O3S
M.W.:
339.76
Type:
Unknown
AlogP:
0.57
Polar Surface Area:
130.87
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4569790 Name:
4-[4-Cyano-5-(4-fluorobenzylidene)amino-1H-pyrazol
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Mol. Formula:
C17H12FN5O2S
M.W.:
369.38
Type:
Unknown
AlogP:
2.28
Polar Surface Area:
114.13
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4567195 Name:
4-[5-(4-Bromobenzylidene)amino-4-cyano-1H-pyrazol-
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Mol. Formula:
C17H12BrN5O2S
M.W.:
430.29
Type:
Unknown
AlogP:
2.90
Polar Surface Area:
114.13
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4529760 Name:
6-(2-(2-Methoxyphenyl)ethenyl)-4,5-dihydropyridazi
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Mol. Formula:
C13H14N2O2
M.W.:
230.27
Type:
Unknown
AlogP:
1.97
Polar Surface Area:
50.69
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.86
DETAILS
CLOSE
ALA4528376 Name:
4,6-dimethyl-5-phenyl-2-[(4-phenyl-1-piperazinyl)m
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Mol. Formula:
C25H26N4O2
M.W.:
414.51
Type:
Unknown
AlogP:
3.47
Polar Surface Area:
48.79
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4547736 Name:
2-(4-Fluorophenyl)-6-(2-(3-Methylphenyl)ethenyl)-4
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Mol. Formula:
C19H17FN2O
M.W.:
308.36
Type:
Unknown
AlogP:
4.33
Polar Surface Area:
32.67
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA4546047 Name:
4,6-dimethyl-5-n-butyl-2-{[4-(o-ethoxyphenyl)-1-pi
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Mol. Formula:
C25H34N4O3
M.W.:
438.57
Type:
Unknown
AlogP:
3.68
Polar Surface Area:
58.02
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4745350 Name:
4-((2-(4-(4-(methylsulfonyl)phenyl)thiazol-2-yl)hy
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Mol. Formula:
C17H15N3O4S2
M.W.:
389.46
Type:
Unknown
AlogP:
3.07
Polar Surface Area:
111.88
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4743827 Name:
N-(2-(1H-indol-3-yl)ethyl)-2,4-dihydroxybenzamide
Mol. Formula:
C17H16N2O3
M.W.:
296.33
Type:
Unknown
AlogP:
2.55
Polar Surface Area:
85.35
HBA:
3
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4740522 Name:
N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-2-(phenylamin
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Mol. Formula:
C24H23N3O2
M.W.:
385.47
Type:
Unknown
AlogP:
4.89
Polar Surface Area:
66.15
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4763059 Name:
2-Methoxy-5-((2-(4-(4-(methylsulfonyl)phenyl)thiaz
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Mol. Formula:
C18H17N3O4S2
M.W.:
403.49
Type:
Unknown
AlogP:
3.37
Polar Surface Area:
100.88
HBA:
8
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4762525 Name:
N-(2-(1H-indol-3-yl)ethyl)-2-hydroxy-5-methylbenza
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Mol. Formula:
C18H18N2O2
M.W.:
294.35
Type:
Unknown
AlogP:
3.15
Polar Surface Area:
65.12
HBA:
2
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4761676 Name:
N-(2-(5-chloro-1H-indol-3-yl)ethyl)-2-(phenylamino
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Mol. Formula:
C23H20ClN3O
M.W.:
389.89
Type:
Unknown
AlogP:
5.54
Polar Surface Area:
56.92
HBA:
2
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4761194 Name:
2-(2-(2,5-dimethoxybenzylidene)hydrazineyl)-4-(4-(
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Mol. Formula:
C19H19N3O4S2
M.W.:
417.51
Type:
Unknown
AlogP:
3.68
Polar Surface Area:
89.88
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4574755 Name:
2-(4-Fluorophenyl)-6-(2-(3-methylphenyl)ethenyl)py
Show More⌵
Mol. Formula:
C19H15FN2O
M.W.:
306.34
Type:
Unknown
AlogP:
3.85
Polar Surface Area:
34.89
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
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