- ALA5282145
Name:
Show More⌵Mol. Formula:
C17H22N6O4SM.W.:
406.47/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
0.79Polar Surface Area:
132.12HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA5274281
Name:
Show More⌵Mol. Formula:
C20H28N6O4SM.W.:
448.55/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
1.82Polar Surface Area:
132.12HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA5316206
Name:
Dehydroglyasperin DMol. Formula:
C22H24O5M.W.:
368.43/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.56Polar Surface Area:
68.15HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA4795966
Name:
N-(4-(2,4-dihydroxyphenyl)thiazol-2-yl)benzamideMol. Formula:
C16H12N2O3SM.W.:
312.35Type:
UnknownAlogP:
3.47Polar Surface Area:
82.45HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS Type:
UnknownAlogP:
1.27Polar Surface Area:
42.23HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.72DETAILSType:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS- ALA4792744
Name:
N-(4-(2,4-dihydroxyphenyl)thiazol-2-yl)-4-(hydroxymethyl)benzamideMol. Formula:
C17H14N2O4SM.W.:
342.38Type:
UnknownAlogP:
2.97Polar Surface Area:
102.68HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS Type:
UnknownAlogP:
2.37Polar Surface Area:
90.90HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.43DETAILSType:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS- ALA4782537
Name:
N-(4-(2,4-dihydroxyphenyl)thiazol-2-yl)acetamideMol. Formula:
C11H10N2O3SM.W.:
250.28Type:
UnknownAlogP:
2.18Polar Surface Area:
82.45HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.76DETAILS Type:
UnknownAlogP:
1.66Polar Surface Area:
42.23HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.77DETAILSType:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS- ALA4763438
Name:
N-(4-(2,4-dihydroxyphenyl)thiazol-2-yl)pivalamideMol. Formula:
C14H16N2O3SM.W.:
292.36Type:
UnknownAlogP:
3.21Polar Surface Area:
82.45HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS Type:
UnknownAlogP:
3.27Polar Surface Area:
48.67HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.67DETAILSType:
UnknownAlogP:
0.00Polar Surface Area:
133.52HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILSType:
UnknownAlogP:
0.00Polar Surface Area:
133.52HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILS- ALA4757374
Name:
N-(4-(2,4-dihydroxyphenyl)thiazol-2-yl)cyclohexanecarboxamideMol. Formula:
C16H18N2O3SM.W.:
318.40Type:
UnknownAlogP:
3.74Polar Surface Area:
82.45HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.80DETAILS