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ALA5271713 Name:
2-(3-((R)-1-(((S)-1-((R)-3-cyclopropyl-2-(3,4,5-trimethoxyphenyl)propanoyl)Show More⌵
Mol. Formula:
C40H49NO11
M.W.:
719.83
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
6.38
Polar Surface Area:
139.29
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
18
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA5270994 Name:
2-(3-((R)-3-(3,4-dimethoxyphenyl)-1-(((S)-1-((R)-2-(3,4,5-trimethoxyphenyl)Show More⌵
Mol. Formula:
C39H47NO11
M.W.:
705.80
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
6.15
Polar Surface Area:
139.29
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
18
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA5268083 Name:
2-(4-((R)-2-((1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)-2,6-dShow More⌵
Mol. Formula:
C19H30N2O5
M.W.:
366.46
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
0.84
Polar Surface Area:
94.99
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA5281156 Name:
(R)-3-(3,4-dimethoxyphenyl)-1-(3-(2-morpholinoethoxy)phenyl)propyl(S)-1-((RShow More⌵
Mol. Formula:
C47H64N2O10
M.W.:
817.03
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
7.79
Polar Surface Area:
114.46
HBA:
11
HBD:
---
#RO5 Violations:
3
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA5286207 Name:
2-(3-((R)-1-(((S)-1-((R)-3-cyclohexyl-2-(3,4,5-trimethoxyphenyl)propanoyl)pShow More⌵
Mol. Formula:
C43H55NO11
M.W.:
761.91
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
7.55
Polar Surface Area:
139.29
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
18
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA5291024 Name:
(R)-3-(3,4-dimethoxyphenyl)-1-(3-(2-morpholinoethoxy)phenyl)propyl(2S)-1-((Show More⌵
Mol. Formula:
C47H62N2O10
M.W.:
815.02
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
7.57
Polar Surface Area:
114.46
HBA:
11
HBD:
---
#RO5 Violations:
3
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA5289205 Name:
2-(3-((1R)-1-(((2S)-1-((2R)-3-(cyclohex-2-en-1-yl)-2-(3,4,5-trimethoxyphenyShow More⌵
Mol. Formula:
C43H53NO11
M.W.:
759.89
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
7.32
Polar Surface Area:
139.29
HBA:
10
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
18
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
ALA5086970 Name:
ddSAFit2
Mol. Formula:
C46H62N2O10
M.W.:
803.01
Type:
Unknown
AlogP:
7.40
Polar Surface Area:
114.46
HBA:
11
HBD:
---
#RO5 Violations:
3
#Rotatable Bonds:
18
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA4879078 Name:
NA
Mol. Formula:
C42H53NO9
M.W.:
715.88
Type:
Unknown
AlogP:
7.84
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4878890 Name:
NA
Mol. Formula:
C43H53NO10
M.W.:
743.89
Type:
Unknown
AlogP:
7.41
Polar Surface Area:
119.06
HBA:
10
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.22
DETAILS
CLOSE
ALA4878667 Name:
NA
Mol. Formula:
C43H55NO11
M.W.:
761.91
Type:
Unknown
AlogP:
6.18
Polar Surface Area:
142.45
HBA:
11
HBD:
2
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4877731 Name:
NA
Mol. Formula:
C46H59NO10
M.W.:
785.98
Type:
Unknown
AlogP:
8.42
Polar Surface Area:
111.22
HBA:
10
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4876664 Name:
(S)-((R)-3-(3,4-dimethoxyphenyl)-1-(3-methoxyphenyl)propyl)-1-((S)-2-cyclohShow More⌵
Mol. Formula:
C41H53NO9
M.W.:
703.87
Type:
Unknown
AlogP:
7.70
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4876415 Name:
NA
Mol. Formula:
C44H55NO10
M.W.:
757.92
Type:
Unknown
AlogP:
7.80
Polar Surface Area:
119.06
HBA:
10
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4875870 Name:
NA
Mol. Formula:
C43H53NO9
M.W.:
727.90
Type:
Unknown
AlogP:
8.01
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA4874574 Name:
NA
Mol. Formula:
C45H59NO10
M.W.:
773.96
Type:
Unknown
AlogP:
8.25
Polar Surface Area:
111.22
HBA:
10
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4872580 Name:
NA
Mol. Formula:
C43H55NO9
M.W.:
729.91
Type:
Unknown
AlogP:
8.23
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4872122 Name:
NA
Mol. Formula:
C43H53NO9
M.W.:
727.90
Type:
Unknown
AlogP:
8.01
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA4871144 Name:
NA
Mol. Formula:
C43H55NO11
M.W.:
761.91
Type:
Unknown
AlogP:
6.18
Polar Surface Area:
142.45
HBA:
11
HBD:
2
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4870008 Name:
NA
Mol. Formula:
C44H57NO9
M.W.:
743.94
Type:
Unknown
AlogP:
8.62
Polar Surface Area:
101.99
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
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