ALA4586284Name:
4-(4-chlorophenoxy)-N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)butanamideMol. Formula:
C18H17ClN2O4S2M.W.:
424.93Type:
UnknownAlogP:
4.15Polar Surface Area:
85.36HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.58DETAILS
ALA4577904Name:
2-bromo-N-(3-(4-oxo-4H-benzo[d][1,3]oxazin-2-yl)phenyl)benzamideMol. Formula:
C21H13BrN2O3M.W.:
421.25Type:
UnknownAlogP:
4.87Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
UnknownAlogP:
3.46Polar Surface Area:
71.53HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS
ALA4556925Name:
5-(2-hydroxy-5-methoxybenzylidene)-2-thioxothiazolidin-4-oneMol. Formula:
C11H9NO3S2M.W.:
267.33Type:
UnknownAlogP:
1.89Polar Surface Area:
58.56HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.63DETAILS
ALA4554066Name:
N'-(3,5-dibromo-2-hydroxybenzylidene)-4-(p-tolylamino)butanehydrazideMol. Formula:
C18H19Br2N3O2M.W.:
469.18Type:
UnknownAlogP:
4.57Polar Surface Area:
73.72HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.32DETAILS- ALA4553877
Name:
3-(5-(2-nitrophenyl)furan-2-yl)benzo[f]quinoline-1-carboxylic acidMol. Formula:
C24H14N2O5M.W.:
410.39Type:
UnknownAlogP:
5.92Polar Surface Area:
106.47HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
UnknownAlogP:
3.47Polar Surface Area:
67.87HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA4526718
Name:
N-(2'-(2-ethylphenylamino)-4-methyl-5,5'-bithiazol-2-yl)acetamideMol. Formula:
C17H18N4OS2M.W.:
358.49Type:
UnknownAlogP:
4.84Polar Surface Area:
66.91HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS
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