ALA4287516Name:
N-((2S,3S)-2-hydroxytetrahydrofuran-3-yl)-3-oxododecanamideMol. Formula:
C16H29NO4M.W.:
299.41Type:
Small moleculeAlogP:
2.31Polar Surface Area:
75.63HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA4285396Name:
3-oxo-N-((tetrahydrofuran-2-yl)methyl)dodecanamideMol. Formula:
C17H31NO3M.W.:
297.44Type:
Small moleculeAlogP:
3.38Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.44DETAILS
Type:
Small moleculeAlogP:
3.32Polar Surface Area:
63.24HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.47DETAILS
Type:
Small moleculeAlogP:
2.99Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.47DETAILS
N-octanoyl-L-homoserine lactoneName:
(S)-N-(2-oxo-tetrahydrofuran-3-yl)octanamideMol. Formula:
C12H21NO3M.W.:
227.30Type:
Small moleculeAlogP:
1.78Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.53DETAILS- ALA264694
Name:
(R)-3-oxo-N-(2-oxo-tetrahydrofuran-3-yl)-4-phenylbutanamideMol. Formula:
C14H15NO4M.W.:
261.28Type:
Small moleculeAlogP:
0.62Polar Surface Area:
72.47HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA408326
Name:
(S)-N-(2-oxo-tetrahydrofuran-3-yl)undecane-1-sulfonamideMol. Formula:
C15H29NO4SM.W.:
319.47Type:
Small moleculeAlogP:
2.75Polar Surface Area:
72.47HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA441888
Name:
(S)-4-oxo-N-(2-oxo-tetrahydrofuran-3-yl)-4-(4-propylphenyl)butanamideMol. Formula:
C17H21NO4M.W.:
303.36Type:
Small moleculeAlogP:
2.03Polar Surface Area:
72.47HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
2.01Polar Surface Area:
93.73HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS - N-(3-(4-bromophenyl)-propanoyl)-L-homoserine lactone
Name:
(S)-3-(4-bromophenyl)-N-(2-oxo-tetrahydrofuran-3-yl)propanamideMol. Formula:
C13H14BrNO3M.W.:
312.16Type:
Small moleculeAlogP:
1.81Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA258913
Name:
(S)-4-bromo-N-(2-oxo-tetrahydrofuran-3-yl)benzamideMol. Formula:
C11H10BrNO3M.W.:
284.11Type:
Small moleculeAlogP:
1.49Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.84DETAILS - ALA265683
Name:
(S)-2-(4-ethoxyphenyl)-N-(2-oxo-tetrahydrofuran-3-yl)acetamideMol. Formula:
C14H17NO4M.W.:
263.29Type:
Small moleculeAlogP:
1.06Polar Surface Area:
64.63HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.81DETAILS - ALA259441
Name:
2-Biphenyl-4-yl-N-((S)-2-oxo-tetrahydro-furan-3-yl)-acetamideMol. Formula:
C18H17NO3M.W.:
295.34Type:
Small moleculeAlogP:
2.33Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA259440
Name:
(S)-tert-butyl 4-((2-oxo-tetrahydrofuran-3-yl)carbamoyl)benzylcarbamateMol. Formula:
C17H22N2O5M.W.:
334.37Type:
Small moleculeAlogP:
1.76Polar Surface Area:
93.73HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA259439
Name:
(S)-4-octyl-N-(2-oxo-tetrahydrofuran-3-yl)benzamideMol. Formula:
C19H27NO3M.W.:
317.43Type:
Small moleculeAlogP:
3.63Polar Surface Area:
55.40HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.56DETAILS
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