- ALA5266641
Name:
Show More⌵Mol. Formula:
C20H21N5M.W.:
330.42/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
3.53Polar Surface Area:
48.01HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS Type:
Small moleculeAlogP:
4.61Polar Surface Area:
84.65HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.36DETAILSType:
Small moleculeAlogP:
3.77Polar Surface Area:
121.95HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.32DETAILSType:
Small moleculeAlogP:
3.88Polar Surface Area:
92.85HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.40DETAILSType:
Small moleculeAlogP:
4.02Polar Surface Area:
119.24HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.32DETAILSType:
Small moleculeAlogP:
5.88Polar Surface Area:
75.78HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.25DETAILSType:
Small moleculeAlogP:
3.76Polar Surface Area:
118.79HBA:
10HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.29DETAILSType:
Small moleculeAlogP:
4.13Polar Surface Area:
110.01HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILSType:
Small moleculeAlogP:
2.26Polar Surface Area:
112.81HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.34DETAILSType:
Small moleculeAlogP:
4.52Polar Surface Area:
116.64HBA:
8HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.37DETAILSType:
Small moleculeAlogP:
4.13Polar Surface Area:
89.70HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.36DETAILSType:
Small moleculeAlogP:
4.07Polar Surface Area:
116.91HBA:
8HBD:
3#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.29DETAILSType:
Small moleculeAlogP:
4.22Polar Surface Area:
97.12HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.41DETAILSType:
Small moleculeAlogP:
2.79Polar Surface Area:
135.08HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.27DETAILSType:
Small moleculeAlogP:
2.98Polar Surface Area:
92.85HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILSType:
Small moleculeAlogP:
2.98Polar Surface Area:
92.85HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILSType:
Small moleculeAlogP:
3.65Polar Surface Area:
122.90HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.32DETAILSType:
Small moleculeAlogP:
2.84Polar Surface Area:
112.81HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILSType:
Small moleculeAlogP:
5.47Polar Surface Area:
104.88HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.26DETAILSType:
Small moleculeAlogP:
3.26Polar Surface Area:
118.79HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.32DETAILS