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ALA2092819 Name:
{[({5-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-3
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Mol. Formula:
C11H18N5O12P3S2
M.W.:
569.34
Type:
Small molecule
AlogP:
-0.79
Polar Surface Area:
262.06
HBA:
15
HBD:
7
#RO5 Violations:
3
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA2092818 Name:
[({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-
Show More⌵
Mol. Formula:
C10H16N5O12P3S
M.W.:
523.25
Type:
Small molecule
AlogP:
-1.51
Polar Surface Area:
262.06
HBA:
14
HBD:
7
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA2029001 Name:
pentakis(tributylamine) [(2R,3S,4R,5R)-5-(6-amino-
Show More⌵
Mol. Formula:
C80H165BN15O21P5
M.W.:
1838.97
Type:
Unknown
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2028999 Name:
[bis({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4
Show More⌵
Mol. Formula:
C56H109BN13O15P3
M.W.:
1308.30
Type:
Unknown
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2093075 Name:
{[({5-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-3
Show More⌵
Mol. Formula:
C11H18N5O12P3S2
M.W.:
569.34
Type:
Small molecule
AlogP:
-0.79
Polar Surface Area:
262.06
HBA:
15
HBD:
7
#RO5 Violations:
3
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA2093074 Name:
[({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-
Show More⌵
Mol. Formula:
C10H16N5O12P3S
M.W.:
523.25
Type:
Small molecule
AlogP:
-1.51
Polar Surface Area:
262.06
HBA:
14
HBD:
7
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA2386493 Name:
(Rp)-[[(2R,3S,4R,5R)-5-(6-amino-2-chloro-purin-9-y
Show More⌵
Mol. Formula:
C10H16BClN5O12P3
M.W.:
537.45
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2364572 Name:
{[({5-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-3
Show More⌵
Mol. Formula:
C11H19BN5O12P3S
M.W.:
549.10
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA2181943 Name:
alpha-borano-2-MeS-ATP
Mol. Formula:
C11H17BN5Na4O12P3S
M.W.:
639.04
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA610595 Name:
[({[5-(6-amino-2-chloro-9H-purin-9-yl)-3,4-dihydro
Show More⌵
Mol. Formula:
C10H18BClN5O12P3
M.W.:
539.46
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA611086 Name:
[({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-
Show More⌵
Mol. Formula:
C10H19BN5O12P3
M.W.:
505.02
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
Type:
Small molecule
AlogP:
-2.56
Polar Surface Area:
387.44
HBA:
23
HBD:
9
#RO5 Violations:
3
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
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