ALA4580193Name:
N-(3-methoxyphenyl)-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS
Type:
UnknownAlogP:
4.76Polar Surface Area:
114.69HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.33DETAILS
ALA4546626Name:
N-(4-methoxyphenyl)-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS
ALA4461368Name:
N-(2-methoxyphenyl)-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS
Type:
UnknownAlogP:
4.47Polar Surface Area:
105.46HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.44DETAILS- ALA4458522
Name:
3-Methoxy-N-(3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)phenyl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA4456348
Name:
2-Methoxy-N-(3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)phenyl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA4453873
Name:
N-(3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)phenyl)benzamideMol. Formula:
C25H21NO6M.W.:
431.44Type:
UnknownAlogP:
4.74Polar Surface Area:
87.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA4443189
Name:
4-Methoxy-N-(3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)phenyl)benzamideMol. Formula:
C26H23NO7M.W.:
461.47Type:
UnknownAlogP:
4.75Polar Surface Area:
96.23HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
UnknownAlogP:
4.44Polar Surface Area:
107.23HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA4439657
Name:
3-(5-Hydroxy-6,7-dimethoxy-4-oxo-4H-chromen-2-yl)-N-phenylbenzamideMol. Formula:
C24H19NO6M.W.:
417.42Type:
UnknownAlogP:
4.44Polar Surface Area:
98.00HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA4437909
Name:
N-phenyl-3-(5,6,7-trimethoxy-4-oxo-4H-chromen-2-yl)benzamideMol. Formula:
C25H21NO6M.W.:
431.44Type:
UnknownAlogP:
4.74Polar Surface Area:
87.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
4.47Polar Surface Area:
105.46HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
Small moleculeAlogP:
5.77Polar Surface Area:
93.21HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
4.65Polar Surface Area:
77.52HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA3122055
Name:
6-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-p-tolylimidazo[2,1-b]thiazoleMol. Formula:
C17H16N4SM.W.:
308.41Type:
Small moleculeAlogP:
4.17Polar Surface Area:
35.12HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA3122054
Name:
3-(4-Chlorophenyl)-6-(3,5-dimethyl-1H-pyrazol-1-yl)imidazo[2,1-b]thiazoleMol. Formula:
C16H13ClN4SM.W.:
328.83Type:
Small moleculeAlogP:
4.52Polar Surface Area:
35.12HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
3.83Polar Surface Area:
88.83HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
Small moleculeAlogP:
6.33Polar Surface Area:
93.98HBA:
8HBD:
---#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.24DETAILS -
Type:
Small moleculeAlogP:
6.45Polar Surface Area:
84.93HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.33DETAILS
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