ALA5271563Name:
4,7-dihydro-2,6-dimethoxy-9,10-dihydrophenanthreneMol. Formula:
C16H18O2M.W.:
242.32Type:
---AlogP:
3.80Polar Surface Area:
18.46HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS
Type:
---AlogP:
4.02Polar Surface Area:
67.57HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS
Type:
---AlogP:
4.77Polar Surface Area:
85.69HBA:
7HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
---AlogP:
5.16Polar Surface Area:
71.84HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILS
Type:
---AlogP:
4.63Polar Surface Area:
124.21HBA:
10HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.21DETAILS-
Type:
---AlogP:
5.52Polar Surface Area:
51.78HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
---AlogP:
4.62Polar Surface Area:
114.98HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.24DETAILS -
Type:
---AlogP:
0.02Polar Surface Area:
158.30HBA:
10HBD:
6#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.39DETAILS -
Type:
---AlogP:
4.93Polar Surface Area:
114.98HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
---AlogP:
3.43Polar Surface Area:
68.15HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
---AlogP:
4.93Polar Surface Area:
67.57HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.39DETAILS -
Type:
---AlogP:
-6.06Polar Surface Area:
280.82HBA:
17HBD:
9#RO5 Violations:
3#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.11DETAILS - ALA5221127
Name:
2-(4-chlorophenyl)-5,6-dihydropyrazolo[1,5-c]quinazolin-5-olMol. Formula:
C16H12ClN3OM.W.:
297.75Type:
---AlogP:
3.74Polar Surface Area:
50.08HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA5170380
Name:
ethyl (E)-3-[4-[(E)-2-(3,4-dihydroxyphenyl)vinyl]phenyl]prop-2-enoateMol. Formula:
C19H18O4M.W.:
310.35Type:
---AlogP:
3.84Polar Surface Area:
66.76HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
UnknownAlogP:
3.99Polar Surface Area:
170.57HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
UnknownAlogP:
2.97Polar Surface Area:
110.13HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
UnknownAlogP:
3.09Polar Surface Area:
106.97HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
UnknownAlogP:
4.88Polar Surface Area:
150.34HBA:
10HBD:
1#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
UnknownAlogP:
3.09Polar Surface Area:
106.97HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
UnknownAlogP:
3.98Polar Surface Area:
86.74HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.29DETAILS
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