Compounds

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ALA2368877
Name:
(2S,3S)-ethyl 3-((2S)-1-(4-hydroxyphenethylamino)-
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Mol. Formula:
C20H28N2O6
M.W.:
392.45

3 activity values

3 unique targets
Type:
Small molecule
AlogP:
0.91
Polar Surface Area:
117.26
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA1221755
Name:
(125I)-(3S,13S,16S)-16-acetamido-13-(4-hydroxy-3-i
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Mol. Formula:
C49H70IN7O10S
M.W.:
1074.11

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1221753
Name:
(125I)-(13S,16S)-16-acetamido-13-(4-hydroxy-3-iodo
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Mol. Formula:
C45H62IN7O10S
M.W.:
1018.00

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA332025
Name:
[1-((S)-7-Oxo-4-oxa-1-aza-bicyclo[3.2.0]hept-6-ylc
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Mol. Formula:
C22H23N3O5
M.W.:
409.44

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
1.21
Polar Surface Area:
96.97
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE