ALA4584760Name:
3-(3,5-dichloro-4-hydroxybenzylidene)-5-(3-fluorophenyl)indolin-2-oneMol. Formula:
C21H12Cl2FNO2M.W.:
400.24Type:
UnknownAlogP:
6.00Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
UnknownAlogP:
3.89Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.78DETAILS
ALA4574044Name:
N-benzyl-3-(3,5-dichloro-4-hydroxybenzylidene)-2-oxoindoline-5-carboxamideMol. Formula:
C23H16Cl2N2O3M.W.:
439.30Type:
UnknownAlogP:
5.12Polar Surface Area:
78.43HBA:
3HBD:
3#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.49DETAILS
ALA4566755Name:
3-(3,5-dichloro-4-hydroxybenzylidene)-5-(furan-2-yl)indolin-2-oneMol. Formula:
C19H11Cl2NO3M.W.:
372.21Type:
UnknownAlogP:
5.45Polar Surface Area:
62.47HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.59DETAILS
ALA4560977Name:
3-((2-chloropyridin-4-yl)methylene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C19H11ClN2O3M.W.:
350.76Type:
UnknownAlogP:
4.05Polar Surface Area:
72.20HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.44DETAILS- ALA4551907
Name:
3-(3,5-difluoro-4-hydroxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C20H11F2NO4M.W.:
367.31Type:
UnknownAlogP:
3.99Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.54DETAILS - ALA4549732
Name:
3-(3,5-dibromo-4-methoxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C21H13Br2NO4M.W.:
503.15Type:
UnknownAlogP:
5.54Polar Surface Area:
68.54HBA:
4HBD:
1#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.38DETAILS - ALA4546858
Name:
3-(3-bromo-4-methoxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C21H14BrNO4M.W.:
424.25Type:
UnknownAlogP:
4.77Polar Surface Area:
68.54HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
UnknownAlogP:
2.47Polar Surface Area:
123.15HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA4539923
Name:
3-(4-bromo-3-hydroxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C20H12BrNO4M.W.:
410.22Type:
UnknownAlogP:
4.47Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
UnknownAlogP:
4.73Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA4535760
Name:
3-(3,5-dibromobenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C20H11Br2NO3M.W.:
473.12Type:
UnknownAlogP:
5.53Polar Surface Area:
59.31HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
4.43Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4533759
Name:
3-(3,5-dichloro-4-hydroxybenzylidene)-5-iodoindolin-2-oneMol. Formula:
C15H8Cl2INO2M.W.:
432.04Type:
UnknownAlogP:
4.80Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA4525843
Name:
5-(furan-2-carbonyl)-3-(3-hydroxybenzylidene)indolin-2-oneMol. Formula:
C20H13NO4M.W.:
331.33Type:
UnknownAlogP:
3.71Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4524425
Name:
5-(furan-2-carbonyl)-3-((6-hydroxypyridin-3-yl)methylene)indolin-2-oneMol. Formula:
C19H12N2O4M.W.:
332.32Type:
UnknownAlogP:
3.10Polar Surface Area:
92.43HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4522721
Name:
3-(3,5-dichloro-4-hydroxybenzylidene)-5-(pyridin-2-yl)indolin-2-oneMol. Formula:
C20H12Cl2N2O2M.W.:
383.23Type:
UnknownAlogP:
5.25Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA4520425
Name:
3-(3-bromo-5-chloro-4-hydroxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C20H11BrClNO4M.W.:
444.67Type:
UnknownAlogP:
5.12Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
UnknownAlogP:
4.37Polar Surface Area:
88.77HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA4466713
Name:
3-(3,5-dibromo-4-hydroxybenzylidene)-5-(furan-2-carbonyl)indolin-2-oneMol. Formula:
C20H11Br2NO4M.W.:
489.12Type:
UnknownAlogP:
5.23Polar Surface Area:
79.54HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.39DETAILS
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