Compounds

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ALA1821964
Name:
(-)-1-[(1R,2R,5S)-5-(Hydroxymethyl)bicyclo[3.1.0]hex-3-en-2-yl]-5-methylpyrShow More⌵
Mol. Formula:
C12H14N2O3
M.W.:
234.25
15 activity values
12 unique targets
Type:
Small molecule
AlogP:
-0.05
Polar Surface Area:
75.09
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA1795536
Name:
[(1R,4S,5S)-4-(6-amino-9H-purin-9-yl)bicyclo[3.1.0]hex-2-en-1-yl]methanol
Mol. Formula:
C12H13N5O
M.W.:
243.27
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
0.52
Polar Surface Area:
89.85
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA1795535
Name:
4-amino-1-[(1S,2S,5R)-5-(hydroxymethyl)bicyclo[3.1.0]hex-3-en-2-yl]pyrimidiShow More⌵
Mol. Formula:
C11H13N3O2
M.W.:
219.24
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
-0.07
Polar Surface Area:
81.14
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA1795534
Name:
4-hydroxy-1-[(1S,2S,5R)-5-(hydroxymethyl)bicyclo[3.1.0]hex-3-en-2-yl]pyrimiShow More⌵
Mol. Formula:
C11H12N2O3
M.W.:
220.23
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
0.06
Polar Surface Area:
75.35
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA1795533
Name:
(-)-2-amino-9-[(1R,2R,5S)-5-(hydroxymethyl)bicyclo[3.1.0]hex-3-en-2-yl]-1H-Show More⌵
Mol. Formula:
C12H13N5O2
M.W.:
259.27
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
0.22
Polar Surface Area:
110.08
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA1795532
Name:
(-)-[(1S,4R,5R)-4-(6-amino-9H-purin-9-yl)bicyclo[3.1.0]hex-2-en-1-yl]methanShow More⌵
Mol. Formula:
C12H13N5O
M.W.:
243.27
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
0.52
Polar Surface Area:
89.85
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA1795531
Name:
(-)-4-Amino-1-[(1R,2R,5S)-5-(hydroxymethyl)bicyclo[3.1.0]hex-3-en-2-yl]pyriShow More⌵
Mol. Formula:
C11H13N3O2
M.W.:
219.24
8 activity values
7 unique targets
Type:
Small molecule
AlogP:
-0.07
Polar Surface Area:
81.14
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE