ALA5274245Name:
N-(4-chlorophenyl)-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C25H20ClNO6M.W.:
465.89Type:
---AlogP:
5.39Polar Surface Area:
87.00HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.41DETAILS
ALA5273112Name:
N-(p-tolyl)-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C26H23NO6M.W.:
445.47Type:
---AlogP:
5.05Polar Surface Area:
87.00HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
---AlogP:
7.08Polar Surface Area:
109.86HBA:
8HBD:
3#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.24DETAILS
Type:
UnknownAlogP:
-0.18Polar Surface Area:
212.45HBA:
13HBD:
6#RO5 Violations:
3#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.09DETAILS
Type:
UnknownAlogP:
-0.44Polar Surface Area:
206.38HBA:
12HBD:
7#RO5 Violations:
3#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.07DETAILS-
Type:
UnknownAlogP:
0.96Polar Surface Area:
148.85HBA:
9HBD:
5#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
UnknownAlogP:
-0.13Polar Surface Area:
195.38HBA:
12HBD:
6#RO5 Violations:
3#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.10DETAILS -
Type:
UnknownAlogP:
-0.15Polar Surface Area:
186.15HBA:
11HBD:
6#RO5 Violations:
3#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.11DETAILS -
Type:
UnknownAlogP:
0.16Polar Surface Area:
175.15HBA:
11HBD:
5#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.13DETAILS -
Type:
UnknownAlogP:
-0.14Polar Surface Area:
195.38HBA:
12HBD:
6#RO5 Violations:
3#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.10DETAILS -
Type:
UnknownAlogP:
0.27Polar Surface Area:
99.13HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
UnknownAlogP:
1.08Polar Surface Area:
89.90HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
UnknownAlogP:
-0.16Polar Surface Area:
101.93HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
UnknownAlogP:
6.99Polar Surface Area:
26.71HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA4282482
Name:
5-(4-Chlorophenyl)-2-phenylthiazolo[3,2-b][1,2,4]triazoleMol. Formula:
C16H10ClN3SM.W.:
311.80Type:
Small moleculeAlogP:
4.78Polar Surface Area:
30.19HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA4250191
Name:
N-(4-methoxyphenyl)-N,5-dimethylfuro[2,3-d]pyrimidin-4-amineMol. Formula:
C15H15N3O2M.W.:
269.30Type:
Small moleculeAlogP:
3.31Polar Surface Area:
51.39HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4170391
Name:
2,3-dihydro-2,3'-biquinoline-2',4(1H,1'H)-dioneMol. Formula:
C18H14N2O2M.W.:
290.32Type:
Small moleculeAlogP:
3.27Polar Surface Area:
61.96HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
Small moleculeAlogP:
4.09Polar Surface Area:
90.15HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
Small moleculeAlogP:
4.73Polar Surface Area:
80.92HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
Small moleculeAlogP:
4.79Polar Surface Area:
80.92HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.30DETAILS
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