ALA4795438Name:
2-(8-hydroxyquinolin-2-yl)-3-(4-(trifluoromethyl)phenyl)thiazolidin-4-oneMol. Formula:
C19H13F3N2O2SM.W.:
390.39Type:
UnknownAlogP:
4.74Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS
ALA4785449Name:
3-(4-fluorophenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C18H13FN2O2SM.W.:
340.38Type:
UnknownAlogP:
3.86Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS
ALA4784882Name:
2-(8-hydroxyquinolin-2-yl)-3-(4-phenoxyphenyl)thiazolidin-4-oneMol. Formula:
C24H18N2O3SM.W.:
414.49Type:
UnknownAlogP:
5.51Polar Surface Area:
62.66HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS
ALA4783117Name:
3-(3,4-dimethoxyphenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C20H18N2O4SM.W.:
382.44Type:
UnknownAlogP:
3.74Polar Surface Area:
71.89HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS
ALA4777085Name:
2-(8-hydroxyquinolin-2-yl)-3-phenylthiazolidin-4-oneMol. Formula:
C18H14N2O2SM.W.:
322.39Type:
UnknownAlogP:
3.72Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.78DETAILS- ALA4764436
Name:
2-(8-hydroxyquinolin-2-yl)-3-(4-isopropylphenyl)thiazolidin-4-oneMol. Formula:
C21H20N2O2SM.W.:
364.47Type:
UnknownAlogP:
4.84Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4759464
Name:
2-(8-hydroxyquinolin-2-yl)-3-m-tolylthiazolidin-4-oneMol. Formula:
C19H16N2O2SM.W.:
336.42Type:
UnknownAlogP:
4.03Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA4758588
Name:
3-(3,5-dimethoxyphenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C20H18N2O4SM.W.:
382.44Type:
UnknownAlogP:
3.74Polar Surface Area:
71.89HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA4755128
Name:
3-(2-(8-hydroxyquinolin-2-yl)-4-oxothiazolidin-3-yl)benzonitrileMol. Formula:
C19H13N3O2SM.W.:
347.40Type:
UnknownAlogP:
3.59Polar Surface Area:
77.22HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA4752621
Name:
2-(8-hydroxyquinolin-2-yl)-3-(4-methoxyphenyl)thiazolidin-4-oneMol. Formula:
C19H16N2O3SM.W.:
352.42Type:
UnknownAlogP:
3.73Polar Surface Area:
62.66HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA4749821
Name:
3-(4-bromophenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C18H13BrN2O2SM.W.:
401.29Type:
UnknownAlogP:
4.48Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA4745980
Name:
3-(3-bromophenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C18H13BrN2O2SM.W.:
401.29Type:
UnknownAlogP:
4.48Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA4743733
Name:
3-(4-chlorophenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C18H13ClN2O2SM.W.:
356.83Type:
UnknownAlogP:
4.37Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA4743353
Name:
2-(8-hydroxyquinolin-2-yl)-3-(2-methoxyphenyl)thiazolidin-4-oneMol. Formula:
C19H16N2O3SM.W.:
352.42Type:
UnknownAlogP:
3.73Polar Surface Area:
62.66HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA4741746
Name:
2-(8-hydroxyquinolin-2-yl)-3-(3,4,5-trimethoxyphenyl)thiazolidin-4-oneMol. Formula:
C21H20N2O5SM.W.:
412.47Type:
UnknownAlogP:
3.74Polar Surface Area:
81.12HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA4740594
Name:
3-(3-fluorophenyl)-2-(8-hydroxyquinolin-2-yl)thiazolidin-4-oneMol. Formula:
C18H13FN2O2SM.W.:
340.38Type:
UnknownAlogP:
3.86Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA4079583
Name:
4-(4-(4-methoxyphenyl)piperazin-1-yl)-2-(pyridin-2-yl)quinazolineMol. Formula:
C24H23N5OM.W.:
397.48Type:
Small moleculeAlogP:
4.03Polar Surface Area:
54.38HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
1.67Polar Surface Area:
83.55HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
Small moleculeAlogP:
1.03Polar Surface Area:
83.55HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
Small moleculeAlogP:
3.35Polar Surface Area:
38.67HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.61DETAILS
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