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ALA4870706 Name:
Di-tert-butyl 2-(4-tert-butoxy-2-((2R,4aS,6aS,12bR
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Mol. Formula:
C49H72N2O10
M.W.:
849.12
Type:
Unknown
AlogP:
8.39
Polar Surface Area:
174.40
HBA:
10
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4869066 Name:
Di-tert-butyl 2-(5-tert-butoxy-4-((2R,4aS,6aS,12bR
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Mol. Formula:
C51H76N2O10
M.W.:
877.17
Type:
Unknown
AlogP:
9.17
Polar Surface Area:
174.40
HBA:
10
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA5287643 Name:
4-[3-(1H-indol-3-yl)-5-{[(2Z)-4-oxo-1,3-thiazolidi
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Mol. Formula:
C21H14N6OS
M.W.:
398.45
Type:
---
AlogP:
3.74
Polar Surface Area:
98.86
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA5287241 Name:
(2Z)-2-{[3-(5-bromo-1-ethyl-1H-indol-3-yl)-1-(4-ch
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Mol. Formula:
C22H17BrClN5OS
M.W.:
514.84
Type:
---
AlogP:
5.78
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5286267 Name:
4-[3-(1-methyl-1H-indol-3-yl)-5-{[(2Z)-4-oxo-1,3-t
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Mol. Formula:
C22H16N6OS
M.W.:
412.48
Type:
---
AlogP:
3.75
Polar Surface Area:
88.00
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA5286192 Name:
(2Z)-2-{[3-(1-ethyl-5-methoxy-1H-indol-3-yl)-1-(2-
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Mol. Formula:
C25H25N5O2S
M.W.:
459.58
Type:
---
AlogP:
4.94
Polar Surface Area:
73.44
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5286109 Name:
(2Z)-2-{[1-(4-chlorophenyl)-3-(1-ethyl-5-methoxy-1
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Mol. Formula:
C23H20ClN5O2S
M.W.:
465.97
Type:
---
AlogP:
5.03
Polar Surface Area:
73.44
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5284567 Name:
(2Z)-2-{[1-(3-chlorophenyl)-3-(1-ethyl-5-methoxy-1
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Mol. Formula:
C23H20ClN5O2S
M.W.:
465.97
Type:
---
AlogP:
5.03
Polar Surface Area:
73.44
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5281890 Name:
(2Z)-2-{[1-(3-chlorophenyl)-3-(1-ethyl-1H-indol-3-
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Mol. Formula:
C22H18ClN5OS
M.W.:
435.94
Type:
---
AlogP:
5.02
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA5281614 Name:
(2Z)-2-{[1-(4-chlorophenyl)-3-(1-methyl-1H-indol-3
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Mol. Formula:
C21H16ClN5OS
M.W.:
421.91
Type:
---
AlogP:
4.53
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA5281502 Name:
(2Z)-2-{[1-(3-chlorophenyl)-3-(5-methoxy-1H-indol-
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Mol. Formula:
C21H16ClN5O2S
M.W.:
437.91
Type:
---
AlogP:
4.53
Polar Surface Area:
84.30
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA5280534 Name:
(2Z)-2-{[3-(5-bromo-1-ethyl-1H-indol-3-yl)-1-(2-et
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Mol. Formula:
C24H22BrN5OS
M.W.:
508.45
Type:
---
AlogP:
5.69
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA5279501 Name:
(2Z)-2-{[3-(5-bromo-1-methyl-1H-indol-3-yl)-1-(4-c
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Mol. Formula:
C21H15BrClN5OS
M.W.:
500.81
Type:
---
AlogP:
5.30
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5279119 Name:
(2Z)-2-{[3-(1-benzyl-5-methoxy-1H-indol-3-yl)-1-(4
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Mol. Formula:
C28H22ClN5O2S
M.W.:
528.04
Type:
---
AlogP:
6.05
Polar Surface Area:
73.44
HBA:
7
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA5278629 Name:
(2Z)-2-{[3-(1-benzyl-1H-indol-3-yl)-1-(3-chlorophe
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Mol. Formula:
C27H20ClN5OS
M.W.:
498.01
Type:
---
AlogP:
6.05
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4867546 Name:
Tert-butyl 3-((2R,4aS,6aS,12bR,14aS,14bR)-10-hydro
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Mol. Formula:
C37H54N2O5
M.W.:
606.85
Type:
Unknown
AlogP:
7.64
Polar Surface Area:
104.73
HBA:
5
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4867174 Name:
Di-tert-butyl 2-(4-tert-butoxy-2-((2R,4aS,6aS,12bR
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Mol. Formula:
C50H74N2O10
M.W.:
863.15
Type:
Unknown
AlogP:
8.78
Polar Surface Area:
174.40
HBA:
10
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA4866722 Name:
Tert-butyl 5-((2-tert-butoxy-2-oxoethyl)(tert-buto
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Mol. Formula:
C49H72N2O10
M.W.:
849.12
Type:
Unknown
AlogP:
9.33
Polar Surface Area:
165.61
HBA:
10
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA5290278 Name:
(2Z)-2-{[3-(5-bromo-1-methyl-1H-indol-3-yl)-1-(3-c
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Mol. Formula:
C21H15BrClN5OS
M.W.:
500.81
Type:
---
AlogP:
5.30
Polar Surface Area:
64.21
HBA:
6
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5290235 Name:
(2Z)-2-{[1-(2-ethylphenyl)-3-(5-methoxy-1-methyl-1
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Mol. Formula:
C24H23N5O2S
M.W.:
445.55
Type:
---
AlogP:
4.45
Polar Surface Area:
73.44
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
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