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ALA4092637 Name:
NA
Mol. Formula:
C69H98N18O19S2
M.W.:
1547.78
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4089025 Name:
NA
Mol. Formula:
C65H98N16O18S2
M.W.:
1455.73
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4088524 Name:
NA
Mol. Formula:
C70H100N14O18S2
M.W.:
1489.78
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4083086 Name:
NA
Mol. Formula:
C63H94N16O19S2
M.W.:
1443.67
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4081142 Name:
NA
Mol. Formula:
C68H95N15O19S2
M.W.:
1490.73
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4472052 Name:
2-(1-((1-(2-naphthoyl)piperidin-4-yl)(methyl)carba
Show More⌵
Mol. Formula:
C40H35N2O6P
M.W.:
670.70
Type:
Unknown
AlogP:
7.62
Polar Surface Area:
115.22
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA4080150 Name:
(4S)-4-((2S,3S)-2-amino-3-methylpentanamido)-5-oxo
Show More⌵
Mol. Formula:
C26H40N4O6
M.W.:
504.63
Type:
Small molecule
AlogP:
1.31
Polar Surface Area:
167.69
HBA:
6
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA4105401 Name:
NA
Mol. Formula:
C73H107N15O16S2
M.W.:
1514.88
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4103492 Name:
(3S)-3-amino-4-((2S,3R)-3-hydroxy-1-oxo-1-(1-oxo-1
Show More⌵
Mol. Formula:
C23H34N4O7
M.W.:
478.55
Type:
Small molecule
AlogP:
-0.74
Polar Surface Area:
187.92
HBA:
7
HBD:
6
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4100180 Name:
(4S)-4-((S)-2-amino-3-carboxypropanamido)-5-oxo-5-
Show More⌵
Mol. Formula:
C24H34N4O8
M.W.:
506.56
Type:
Small molecule
AlogP:
-0.26
Polar Surface Area:
204.99
HBA:
7
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4098176 Name:
(4S)-4-((2S,3R)-2-amino-3-hydroxybutanamido)-5-oxo
Show More⌵
Mol. Formula:
C24H36N4O7
M.W.:
492.57
Type:
Small molecule
AlogP:
-0.35
Polar Surface Area:
187.92
HBA:
7
HBD:
6
#RO5 Violations:
1
#Rotatable Bonds:
16
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA4097952 Name:
NA
Mol. Formula:
C79H103N15O17S2
M.W.:
1598.92
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4097688 Name:
NA
Mol. Formula:
C72H105N15O16S2
M.W.:
1500.85
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4095237 Name:
NA
Mol. Formula:
C60H96N16O19S2
M.W.:
1409.66
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4070520 Name:
NA
Mol. Formula:
C73H106N14O17S2
M.W.:
1515.87
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4069983 Name:
NA
Mol. Formula:
C72H104N14O17S2
M.W.:
1501.84
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4078196 Name:
NA
Mol. Formula:
C70H98N14O19S2
M.W.:
1503.77
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4077874 Name:
NA
Mol. Formula:
C69H97N15O19S2
M.W.:
1504.76
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4074776 Name:
NA
Mol. Formula:
C63H94N16O20S2
M.W.:
1459.67
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4061897 Name:
NA
Mol. Formula:
C70H101N15O17S2
M.W.:
1488.80
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
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