ALA4251158Name:
N-(4'-Hydroxy-3'-methoxybenzyl)-3-(octadec-(9''Z)-en-1-ylseleno)propanamideMol. Formula:
C29H49NO3SeM.W.:
538.68Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA4250750Name:
N-(4'-Hydroxy-3'-methoxybenzyl)-10-hydroxy-12-oxooctadecanamideMol. Formula:
C26H43NO5M.W.:
449.63Type:
Small moleculeAlogP:
5.43Polar Surface Area:
95.86HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
19Passes Ro3:
NQED Weighted:
0.24DETAILS
Type:
Small moleculeAlogP:
7.15Polar Surface Area:
78.79HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
22Passes Ro3:
NQED Weighted:
0.11DETAILS
Type:
Small moleculeAlogP:
6.51Polar Surface Area:
43.09HBA:
1HBD:
1#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.29DETAILS-
Type:
Small moleculeAlogP:
7.12Polar Surface Area:
84.58HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
22Passes Ro3:
NQED Weighted:
0.12DETAILS - ALA4249976
Name:
N'-(4'-Hydroxy-3'-methoxybenzylidene)octadec-(9Z)-enohydrazideMol. Formula:
C26H42N2O3M.W.:
430.63Type:
Small moleculeAlogP:
6.89Polar Surface Area:
70.92HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.12DETAILS - ALA4249973
Name:
N'-(4'-Hydroxy-3'-methoxybenzylidene)hexadecanohydrazideMol. Formula:
C24H40N2O3M.W.:
404.60Type:
Small moleculeAlogP:
6.33Polar Surface Area:
70.92HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.18DETAILS -
Type:
Small moleculeAlogP:
7.16Polar Surface Area:
84.86HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
23Passes Ro3:
NQED Weighted:
0.12DETAILS -
Type:
Small moleculeAlogP:
8.06Polar Surface Area:
58.56HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.19DETAILS -
Type:
Small moleculeAlogP:
6.56Polar Surface Area:
84.58HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
4.35Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4244372
Name:
N-(4'-Hydroxy-3'-methoxybenzyl)-(12R)-hydroxyoctadec-(9E)-enamideMol. Formula:
C26H43NO4M.W.:
433.63Type:
Small moleculeAlogP:
6.03Polar Surface Area:
78.79HBA:
4HBD:
3#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.20DETAILS - ALA4243946
Name:
3-(Hexadecylthio)-N-(4'-hydroxy-3'-methoxybenzyl)-propanamideMol. Formula:
C27H47NO3SM.W.:
465.74Type:
Small moleculeAlogP:
7.62Polar Surface Area:
58.56HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.18DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4243028
Name:
N-(4'-Hydroxy-3'-methoxybenzyl)docosa-(13Z,16Z)-dienamideMol. Formula:
C30H49NO3M.W.:
471.73Type:
Small moleculeAlogP:
8.39Polar Surface Area:
58.56HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
Small moleculeAlogP:
6.10Polar Surface Area:
110.88HBA:
7HBD:
3#RO5 Violations:
2#Rotatable Bonds:
23Passes Ro3:
NQED Weighted:
0.11DETAILS -
Type:
Small moleculeAlogP:
7.95Polar Surface Area:
58.56HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.14DETAILS - ALA4240986
Name:
N-(4'-Hydroxy-3'-methoxybenzyl)-12-oxooctadec-(9E)-enamideMol. Formula:
C26H41NO4M.W.:
431.62Type:
Small moleculeAlogP:
6.23Polar Surface Area:
75.63HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.21DETAILS
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