Compounds

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ALA3127352
Name:
(2S)-1,1,1-Trifluoro-2-(4-((2S)-2-(((3S)-3-methyl-
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Mol. Formula:
C23H30F3N3O4S2
M.W.:
533.64

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
3.12
Polar Surface Area:
73.32
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA3127351
Name:
(2S)-1,1,1-Trifluoro-2-(4-((2S)-2-(tetrahydro-2H-p
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Mol. Formula:
C23H29F3N2O4S2
M.W.:
518.62

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
4.21
Polar Surface Area:
70.08
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA3127350
Name:
(2R)-1,1,1-Trifluoro-2-(4-((2S)-2-(tetrahydro-2H-p
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Mol. Formula:
C23H29F3N2O4S2
M.W.:
518.62

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
4.21
Polar Surface Area:
70.08
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA3127349
Name:
1,1,1,3,3,3-Hexafluoro-2-(4-((2S)-2-(((3S)-3-methy
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Mol. Formula:
C23H27F6N3O4S2
M.W.:
587.61

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
3.66
Polar Surface Area:
73.32
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA3127348
Name:
1,1,1,3,3,3-Hexafluoro-2-(4-((2S)-2-(4-morpholinyl
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Mol. Formula:
C22H25F6N3O4S2
M.W.:
573.58

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
3.27
Polar Surface Area:
73.32
HBA:
7
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA3127347
Name:
1,1,1,3,3,3-Hexafluoro-2-(4-((2S)-2-(tetrahydro-2H
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Mol. Formula:
C23H26F6N2O4S2
M.W.:
572.59

2 activity values

2 unique targets
Type:
Small molecule
AlogP:
4.76
Polar Surface Area:
70.08
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE