ALA4866805Name:
N-(4-chlorophenyl)-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C18H15ClN2O3SM.W.:
374.85Type:
UnknownAlogP:
4.67Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS
ALA4850907Name:
N-(2,2-difluoroethyl)-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C14H14F2N2O3SM.W.:
328.34Type:
UnknownAlogP:
2.76Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.88DETAILS
ALA4850023Name:
N-(4-bromophenyl)-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C18H15BrN2O3SM.W.:
419.30Type:
UnknownAlogP:
4.78Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.65DETAILS
Type:
UnknownAlogP:
5.69Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS
ALA4848537Name:
N-(2-naphthyl)-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C22H18N2O3SM.W.:
390.46Type:
UnknownAlogP:
5.17Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS- ALA4848533
Name:
4-[[4-(2-cyclopropyl-5-oxazolyl)phenyl]sulfonyl]morpholineMol. Formula:
C16H18N2O4SM.W.:
334.40Type:
UnknownAlogP:
2.24Polar Surface Area:
72.64HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA4846431
Name:
N-(4-fluorophenyl)-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C18H15FN2O3SM.W.:
358.39Type:
UnknownAlogP:
4.16Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA4846325
Name:
N-[2-(methylsulfonyl)ethyl]-4-(2-cyclopropyl-5-oxazolyl)benzenesulfonamideMol. Formula:
C15H18N2O5S2M.W.:
370.45Type:
UnknownAlogP:
1.54Polar Surface Area:
106.34HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA3409056
Name:
(Z)-3-(Benzo[d]thiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrileMol. Formula:
C19H16N2O3SM.W.:
352.42Type:
Small moleculeAlogP:
4.39Polar Surface Area:
64.37HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA3409054
Name:
(Z)-3-(Benzofuran-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrileMol. Formula:
C19H15NO3M.W.:
305.33Type:
Small moleculeAlogP:
4.51Polar Surface Area:
55.39HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA3409053
Name:
(Z)-3-(Benzofuran-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrileMol. Formula:
C20H17NO4M.W.:
335.36Type:
Small moleculeAlogP:
4.52Polar Surface Area:
64.62HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
5.65Polar Surface Area:
80.20HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.34DETAILS - ALA3409051
Name:
(Z)-2-(3,4-Dimethoxyphenyl)-3-(1H-indol-2-yl)acrylonitrileMol. Formula:
C19H16N2O2M.W.:
304.35Type:
Small moleculeAlogP:
4.25Polar Surface Area:
58.04HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA3409050
Name:
(Z)-3-(1H-indol-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrileMol. Formula:
C20H18N2O3M.W.:
334.38Type:
Small moleculeAlogP:
4.26Polar Surface Area:
67.27HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
Small moleculeAlogP:
5.06Polar Surface Area:
71.44HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
4.31Polar Surface Area:
53.09HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
Small moleculeAlogP:
4.32Polar Surface Area:
111.87HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
3.31Polar Surface Area:
83.47HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
2.66Polar Surface Area:
83.47HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.85DETAILS
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