Compounds

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ALA5221019
Name:
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3,4,5-trihydroShow More⌵
Mol. Formula:
C17H16N2O4S
M.W.:
344.39
7 activity values
7 unique targets
Type:
---
AlogP:
3.26
Polar Surface Area:
113.58
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA5220592
Name:
N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3,4,5-trihydroxybenzamiShow More⌵
Mol. Formula:
C16H14N2O4S
M.W.:
330.37
6 activity values
6 unique targets
Type:
---
AlogP:
2.87
Polar Surface Area:
113.58
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA5220303
Name:
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3,4,5-trihydroxybenzaShow More⌵
Mol. Formula:
C15H12N2O4S
M.W.:
316.34
7 activity values
7 unique targets
Type:
---
AlogP:
2.48
Polar Surface Area:
113.58
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA5220161
Name:
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3,4,5-trihydroxybenzamide
Mol. Formula:
C14H12N2O4S
M.W.:
304.33
6 activity values
6 unique targets
Type:
---
AlogP:
2.61
Polar Surface Area:
113.58
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE