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ALA4519799 Name:
8-ethyl-5-oxo-2-(4-(3-(1-(4-(trifluoromethyl)pheny
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Mol. Formula:
C25H24F3N9O4S
M.W.:
603.59
Type:
Unknown
AlogP:
2.34
Polar Surface Area:
152.23
HBA:
12
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA4518615 Name:
Paleacenin B
Mol. Formula:
C36H48O8
M.W.:
608.77
Type:
Unknown
AlogP:
8.03
Polar Surface Area:
141.36
HBA:
8
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
14
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA4744378 Name:
3-((4-chlorophenyl)(5,7-di-tert-butylbenzofuran-2-
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Mol. Formula:
C31H31ClN2O3
M.W.:
515.05
Type:
Unknown
AlogP:
9.25
Polar Surface Area:
72.07
HBA:
3
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA4763979 Name:
3-(benzofuran-2-yl(phenyl)methyl)-1H-indole
Mol. Formula:
C23H17NO
M.W.:
323.40
Type:
Unknown
AlogP:
6.09
Polar Surface Area:
28.93
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4756316 Name:
3-(benzofuran-2-yl(4-methoxyphenyl)methyl)-2-methy
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Mol. Formula:
C25H21NO2
M.W.:
367.45
Type:
Unknown
AlogP:
6.41
Polar Surface Area:
38.16
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4755866 Name:
3-(benzofuran-2-yl(phenyl)methyl)-5-nitro-1H-indol
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Mol. Formula:
C23H16N2O3
M.W.:
368.39
Type:
Unknown
AlogP:
6.00
Polar Surface Area:
72.07
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4780205 Name:
3-(benzofuran-2-yl(4-methoxyphenyl)methyl)-1H-indo
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Mol. Formula:
C24H19NO2
M.W.:
353.42
Type:
Unknown
AlogP:
6.10
Polar Surface Area:
38.16
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4782650 Name:
2-(benzofuran-2-yl(4-methoxyphenyl)methyl)-3-methy
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Mol. Formula:
C25H21NO2
M.W.:
367.45
Type:
Unknown
AlogP:
6.41
Polar Surface Area:
38.16
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4781840 Name:
3-((5,7-di-tert-butylbenzofuran-2-yl)(phenyl)methy
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Mol. Formula:
C31H32N2O3
M.W.:
480.61
Type:
Unknown
AlogP:
8.60
Polar Surface Area:
72.07
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4781792 Name:
3-((5,7-di-tert-butylbenzofuran-2-yl)(4-methoxyphe
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Mol. Formula:
C32H34N2O4
M.W.:
510.63
Type:
Unknown
AlogP:
8.61
Polar Surface Area:
81.30
HBA:
4
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA4753528 Name:
3-((5-chlorobenzofuran-2-yl)(phenyl)methyl)-1H-ind
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Mol. Formula:
C23H16ClNO
M.W.:
357.84
Type:
Unknown
AlogP:
6.75
Polar Surface Area:
28.93
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4751909 Name:
3-((5,7-di-tert-butylbenzofuran-2-yl)(phenyl)methy
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Mol. Formula:
C32H35NO
M.W.:
449.64
Type:
Unknown
AlogP:
9.00
Polar Surface Area:
28.93
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4751764 Name:
3-((5-chlorobenzofuran-2-yl)(phenyl)methyl)-2-meth
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Mol. Formula:
C24H18ClNO
M.W.:
371.87
Type:
Unknown
AlogP:
7.06
Polar Surface Area:
28.93
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4751207 Name:
3-((4-chlorophenyl)(5,7-di-tert-butylbenzofuran-2-
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Mol. Formula:
C32H34ClNO
M.W.:
484.08
Type:
Unknown
AlogP:
9.65
Polar Surface Area:
28.93
HBA:
1
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4795476 Name:
2-((5-methoxybenzofuran-2-yl)(phenyl)methyl)-3-met
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Mol. Formula:
C25H21NO2
M.W.:
367.45
Type:
Unknown
AlogP:
6.41
Polar Surface Area:
38.16
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4793585 Name:
3-((5-methoxybenzofuran-2-yl)(phenyl)methyl)-1H-in
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Mol. Formula:
C24H19NO2
M.W.:
353.42
Type:
Unknown
AlogP:
6.10
Polar Surface Area:
38.16
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5282254 Name:
4-(3,5-dimethoxystyryl)phenyl 2-((5-(pyridin-4-yl)
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Mol. Formula:
C25H21N3O5S
M.W.:
475.53
Type:
---
AlogP:
5.02
Polar Surface Area:
96.57
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA5281721 Name:
N-(4-(3,5-dimethoxystyryl)phenyl)-2-((5-(2-fluorop
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Mol. Formula:
C26H22FN3O4S
M.W.:
491.54
Type:
---
AlogP:
5.79
Polar Surface Area:
86.48
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA5281338 Name:
N-(4-(3,5-dimethoxystyryl)phenyl)-2-((5-(4-methoxy
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Mol. Formula:
C27H25N3O5S
M.W.:
503.58
Type:
---
AlogP:
5.66
Polar Surface Area:
95.71
HBA:
8
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA5281176 Name:
(2-phenyl-7-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a
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Mol. Formula:
C38H36N6O5S
M.W.:
688.81
Type:
---
AlogP:
6.36
Polar Surface Area:
110.53
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
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