- ALA5316227
Name:
PASIREOTIDE (DITRIFLUOROACETATE)Mol. Formula:
C62H68F6N10O13M.W.:
1275.27/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA5316219
Name:
QUINAGOLIDE (HYDROCHLORIDE)Mol. Formula:
C20H34ClN3O3SM.W.:
432.03/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
2.14Polar Surface Area:
72.88HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.74DETAILS Type:
UnknownAlogP:
1.15Polar Surface Area:
54.88HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILSType:
UnknownAlogP:
1.15Polar Surface Area:
36.68HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.55DETAILS- 2-morpholin-4-ylacetic Acid;hydrochloride
Name:
4'-O-methyl QuercetinMol. Formula:
C6H12ClNO3M.W.:
181.62Type:
UnknownAlogP:
-0.60Polar Surface Area:
49.77HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.56DETAILS Type:
UnknownAlogP:
1.54Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILSType:
UnknownAlogP:
5.24Polar Surface Area:
80.15HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.41DETAILS- ALA4591460
Name:
MK-0557Mol. Formula:
C22H19FN4O3M.W.:
406.42/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
UnknownAlogP:
3.60Polar Surface Area:
86.11HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4588937
Name:
Meldonium hydrateÊMol. Formula:
M.W.:
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS Type:
UnknownAlogP:
1.17Polar Surface Area:
107.19HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.68DETAILS- ALA4587343
Name:
ATORVASTATINMol. Formula:
M.W.:
/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS