Compounds

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ALA4242598
Name:
6-((1S,4S)-5-acryloyl-2,5-diazabicyclo[2.2.1]hepta
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Mol. Formula:
C26H24N4O4
M.W.:
456.50

21 activity values

8 unique targets
Type:
Small molecule
AlogP:
3.74
Polar Surface Area:
97.99
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
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ALA3601223
Name:
N-(3-(((5-chloro-2-((2-methoxy-4-(4-methylpiperazi
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Cas Number:
1805787-93-2

Mol. Formula:
C26H30ClN7O2
M.W.:
508.03

66 activity values

28 unique targets
Type:
Small molecule
AlogP:
4.37
Polar Surface Area:
94.65
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA2348865
Name:
6-(4-(1H-1,2,4-triazol-3-yl)phenyl)-1-(2-(tetrahyd
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Cas Number:
1021920-32-0

Mol. Formula:
C20H21N7O2
M.W.:
391.44

271 activity values

236 unique targets
Type:
Small molecule
AlogP:
2.39
Polar Surface Area:
114.37
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA450519
Name:
3-(4-amino-7-(piperidin-4-yl)-7H-pyrrolo[2,3-d]pyr
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Mol. Formula:
C17H19N5O
M.W.:
309.37

208 activity values

193 unique targets
Type:
Small molecule
AlogP:
2.31
Polar Surface Area:
88.99
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE