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ALA5281778 Name:
Mol. Formula:
C40H37BF2N8O7
M.W.:
790.59
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5289040 Name:
Mol. Formula:
C39H35BF2N8O7
M.W.:
776.57
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5288015 Name:
Mol. Formula:
C40H37BF2N8O8
M.W.:
806.59
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5285029 Name:
Mol. Formula:
C41H39BF2N8O7
M.W.:
804.62
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4879017 Name:
2,8-Dioxo-2,8-dihydropyrano[2,3-f]chromene-3,9-dicarboxylic Acid
Mol. Formula:
C14H6O8
M.W.:
302.19
Type:
Unknown
AlogP:
1.30
Polar Surface Area:
135.02
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4878979 Name:
6-(2-Methoxyphenyl)-2,8-dioxo-2,8-dihydropyrano[2,3-f]-chromene-3,9-dicarboShow More⌵
Mol. Formula:
C21H12O9
M.W.:
408.32
Type:
Unknown
AlogP:
2.97
Polar Surface Area:
144.25
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4878047 Name:
NA
Mol. Formula:
C17H12O6
M.W.:
312.28
Type:
Unknown
AlogP:
2.87
Polar Surface Area:
96.97
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA4876009 Name:
NA
Mol. Formula:
C15H8Cl2N2O4
M.W.:
351.15
Type:
Unknown
AlogP:
3.79
Polar Surface Area:
100.38
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4875771 Name:
NA
Mol. Formula:
C16H9FO5
M.W.:
300.24
Type:
Unknown
AlogP:
3.00
Polar Surface Area:
87.74
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4875041 Name:
NA
Mol. Formula:
C16H10O5
M.W.:
282.25
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
87.74
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4875009 Name:
NA
Mol. Formula:
C21H11FO9
M.W.:
426.31
Type:
Unknown
AlogP:
3.11
Polar Surface Area:
144.25
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4872368 Name:
NA
Mol. Formula:
C16H9FO5
M.W.:
300.24
Type:
Unknown
AlogP:
3.00
Polar Surface Area:
87.74
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA4871203 Name:
NA
Mol. Formula:
C21H12O9
M.W.:
408.32
Type:
Unknown
AlogP:
2.97
Polar Surface Area:
144.25
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4870255 Name:
NA
Mol. Formula:
C14H6O9
M.W.:
318.19
Type:
Unknown
AlogP:
1.00
Polar Surface Area:
155.25
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4870213 Name:
NA
Mol. Formula:
C21H12O9
M.W.:
408.32
Type:
Unknown
AlogP:
2.97
Polar Surface Area:
144.25
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4869539 Name:
6-(3-Fluorophenyl)-2,8-dioxo-2,8-dihydropyrano[2,3-f]-chromene-3,9-dicarboxShow More⌵
Mol. Formula:
C20H9FO8
M.W.:
396.28
Type:
Unknown
AlogP:
3.10
Polar Surface Area:
135.02
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
G-KG Name:
NA
Mol. Formula:
C10H4O4S3
M.W.:
284.34
Type:
Unknown
AlogP:
3.57
Polar Surface Area:
74.60
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA4865638 Name:
2,8-Dioxo-6-(thiophen-2-yl)-2,8-dihydropyrano[2,3-f]chromene-3,9-dicarboxylShow More⌵
Mol. Formula:
C18H8O8S
M.W.:
384.32
Type:
Unknown
AlogP:
3.02
Polar Surface Area:
135.02
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA4862654 Name:
NA
Mol. Formula:
C15H8O8
M.W.:
316.22
Type:
Unknown
AlogP:
1.60
Polar Surface Area:
135.02
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4861414 Name:
6-(2-Fluorophenyl)-2,8-dioxo-2,8-dihydropyrano[2,3-f]-chromene-3,9-dicarboxShow More⌵
Mol. Formula:
C20H9FO8
M.W.:
396.28
Type:
Unknown
AlogP:
3.10
Polar Surface Area:
135.02
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
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