- ALA5272660
Name:
1-acetyl-2-(4-(benzyloxy)benzylidene)indolin-3-oneMol. Formula:
C24H19NO3M.W.:
369.42/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.86Polar Surface Area:
46.61HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA5272652
Name:
Denigrin BMol. Formula:
C31H25NO5M.W.:
491.54/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.55Polar Surface Area:
101.23HBA:
5HBD:
4#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.28DETAILS - ALA5272617
Name:
Show More⌵Mol. Formula:
C24H22F3N5O2S2M.W.:
533.60/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.44Polar Surface Area:
79.38HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.33DETAILS - ALA5272613
Name:
Show More⌵Mol. Formula:
C21H19F3N2O2M.W.:
388.39/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.20Polar Surface Area:
51.22HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA5272602
Name:
Show More⌵Mol. Formula:
C24H23N3O3M.W.:
401.47/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
3.80Polar Surface Area:
90.38HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA5272576
Name:
4,4,4-trifluoro-1-(4-fluoro-4-(pyridin-2-yl)piperidin-1-yl)butan-1-oneMol. Formula:
C15H15F7N2OM.W.:
372.28/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.23Polar Surface Area:
33.20HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA5272571
Name:
Show More⌵Mol. Formula:
C17H18FN5O4SM.W.:
407.43/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
0.16Polar Surface Area:
130.23HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA5272504
Name:
Show More⌵Mol. Formula:
C18H21N5O4SM.W.:
403.46/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
1.06Polar Surface Area:
119.23HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA5272461
Name:
Show More⌵Mol. Formula:
C15H13N7O2SM.W.:
355.38/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
0.59Polar Surface Area:
126.45HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA5272420
Name:
1-acetyl-2-(4-(4-chlorophenoxy)benzylidene)indolin-3-oneMol. Formula:
C23H16ClNO3M.W.:
389.84/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.72Polar Surface Area:
46.61HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.54DETAILS - ALA5272381
Name:
Show More⌵Mol. Formula:
C16H18N6O4SM.W.:
390.43/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
0.06Polar Surface Area:
132.12HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA5272379
Name:
Show More⌵Mol. Formula:
C12H13F3N2O3SM.W.:
322.31/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
2.16Polar Surface Area:
67.43HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA5272369
Name:
Show More⌵Mol. Formula:
C23H19N3O3SM.W.:
417.49/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.26Polar Surface Area:
67.93HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA5272366
Name:
Show More⌵Mol. Formula:
C17H16F3N3O4S2M.W.:
447.46/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.68Polar Surface Area:
77.73HBA:
8HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.38DETAILS - ALA5272334
Name:
(R)-2-amino-N-(2-(4-methoxybenzyl)benzo[d]oxazol-5-yl)-3-phenylpropanamideMol. Formula:
C24H23N3O3M.W.:
401.47/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
3.94Polar Surface Area:
90.38HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA5272330
Name:
N-(3,5-Difluorophenyl)-2-((6-methoxy-2-methylquinolin-4-yl)-oxy)acetamideMol. Formula:
C19H16F2N2O3M.W.:
358.34/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
3.85Polar Surface Area:
60.45HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA5272309
Name:
Show More⌵Mol. Formula:
C27H22Br2N6OM.W.:
606.32/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
6.64Polar Surface Area:
87.98HBA:
4HBD:
5#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.16DETAILS - ALA5272306
Name:
Show More⌵Mol. Formula:
C21H16N4O2SM.W.:
388.45/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.65Polar Surface Area:
71.59HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA5272195
Name:
(R)-2-amino-N-(2-(4-methoxyphenyl)benzo[d]oxazol-5-yl)-3-phenylpropanamideMol. Formula:
C23H21N3O3M.W.:
387.44/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
4.01Polar Surface Area:
90.38HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA5272176
Name:
Show More⌵Mol. Formula:
C27H24N6OSM.W.:
480.60/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
5.63Polar Surface Area:
79.73HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.24DETAILS