Type:
---AlogP:
1.98Polar Surface Area:
91.81HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
---AlogP:
-0.86Polar Surface Area:
114.22HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.19DETAILS
Type:
---AlogP:
2.07Polar Surface Area:
36.36HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.75DETAILS
ALA5290696Name:
4-[(1R)-1-aminoethyl]-N-methyl-N-(4-pyridyl)cyclohexanecarboxamideMol. Formula:
C15H23N3OM.W.:
261.37Type:
---AlogP:
2.20Polar Surface Area:
59.22HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.91DETAILS
ALA5289080Name:
N-(4-anilinophenyl)-2-(2-methylphenoxy)acetamideMol. Formula:
C21H20N2O2M.W.:
332.40Type:
---AlogP:
4.76Polar Surface Area:
50.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.68DETAILS- ALA5288657
Name:
N-(4-anilinophenyl)-2-(3-methylphenoxy)acetamideMol. Formula:
C21H20N2O2M.W.:
332.40Type:
---AlogP:
4.76Polar Surface Area:
50.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
---AlogP:
6.16Polar Surface Area:
61.93HBA:
4HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.30DETAILS - ALA5285058
Name:
(3Z)-5-bromo-3-[(3-bromo-4,5-dihydroxy-phenyl)methylene]indolin-2-oneMol. Formula:
C15H9Br2NO3M.W.:
411.05Type:
---AlogP:
4.12Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
---AlogP:
4.30Polar Surface Area:
100.39HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
---AlogP:
4.29Polar Surface Area:
59.21HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
---AlogP:
3.76Polar Surface Area:
55.43HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
1.78Polar Surface Area:
117.77HBA:
10HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
4.20Polar Surface Area:
101.64HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
3.59Polar Surface Area:
114.53HBA:
10HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
5.39Polar Surface Area:
86.72HBA:
6HBD:
3#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
2.94Polar Surface Area:
136.65HBA:
11HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
1.71Polar Surface Area:
112.22HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
UnknownAlogP:
3.19Polar Surface Area:
91.47HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
UnknownAlogP:
1.96Polar Surface Area:
102.85HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
3.73Polar Surface Area:
114.78HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS
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