Type:
UnknownAlogP:
1.76Polar Surface Area:
144.31HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.26DETAILSType:
UnknownAlogP:
1.76Polar Surface Area:
144.31HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.26DETAILSType:
Small moleculeAlogP:
10.41Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.10DETAILSType:
Small moleculeAlogP:
8.12Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
7.89Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.19DETAILSType:
Small moleculeAlogP:
10.37Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
7.12Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.24DETAILSType:
Small moleculeAlogP:
9.07Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
8.01Polar Surface Area:
104.10HBA:
10HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
9.07Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
7.28Polar Surface Area:
100.19HBA:
10HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILSType:
Small moleculeAlogP:
8.81Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.16DETAILS- ALA4091251
Name:
14-N-(Cyclopropanecarboxylic acid)-tetrandrineMol. Formula:
C42H47N3O7M.W.:
705.85Type:
Small moleculeAlogP:
7.51Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILS Type:
Small moleculeAlogP:
8.47Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.20DETAILSType:
Small moleculeAlogP:
6.09Polar Surface Area:
111.19HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.25DETAILSType:
Small moleculeAlogP:
9.72Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
8.15Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.22DETAILSType:
Small moleculeAlogP:
8.37Polar Surface Area:
100.19HBA:
10HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.20DETAILSType:
Small moleculeAlogP:
8.48Polar Surface Area:
90.96HBA:
10HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILSType:
Small moleculeAlogP:
9.57Polar Surface Area:
90.96HBA:
9HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILS