Compounds

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ALA2286887
Name:
2-(3-oxo-4-(prop-2-ynyl)-3,4-dihydro-2H-benzo[b][1
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Cas Number:
103361-04-2

Mol. Formula:
C19H16N2O4
M.W.:
336.35

3 activity values

3 unique targets
Type:
Small molecule
AlogP:
1.79
Polar Surface Area:
66.92
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.61
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ALA2286886
Name:
2-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-isoindole
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Cas Number:
39985-60-9

Mol. Formula:
C14H12FNO2
M.W.:
245.25

3 activity values

3 unique targets
Type:
Small molecule
AlogP:
2.57
Polar Surface Area:
37.38
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
Y
QED Weighted:
0.71
DETAILS
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ALA2286885
Name:
2-phenyl-4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-d
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Cas Number:
39985-59-6

Mol. Formula:
C14H13NO2
M.W.:
227.26

3 activity values

3 unique targets
Type:
Small molecule
AlogP:
2.43
Polar Surface Area:
37.38
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
Y
QED Weighted:
0.69
DETAILS
CLOSE