rac N-(2,3-Dihydroxypropyl)octadecanamideName:
Octadecanoic acid (2,3-dihydroxy-propyl)-amideMol. Formula:
C21H43NO3M.W.:
357.58Type:
Small moleculeAlogP:
4.72Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
19Passes Ro3:
NQED Weighted:
0.29DETAILS
ALA416075Name:
8-Nonylsulfanyl-octanoic acid (2,3-dihydroxy-propyl)-amideMol. Formula:
C20H41NO3SM.W.:
375.62Type:
Small moleculeAlogP:
4.28Polar Surface Area:
69.56HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
19Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
Small moleculeAlogP:
5.90Polar Surface Area:
37.30HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.36DETAILS
Type:
Small moleculeAlogP:
5.90Polar Surface Area:
37.30HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.36DETAILS
Type:
Small moleculeAlogP:
6.33Polar Surface Area:
37.30HBA:
1HBD:
1#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.34DETAILS- ALA42811
Name:
9-Octylsulfanyl-nonanoic acid (2,3-dihydroxy-propyl)-amideMol. Formula:
C20H41NO3SM.W.:
375.62Type:
Small moleculeAlogP:
4.28Polar Surface Area:
69.56HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
19Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
Small moleculeAlogP:
5.90Polar Surface Area:
37.30HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
5.90Polar Surface Area:
37.30HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
4.91Polar Surface Area:
60.36HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
Small moleculeAlogP:
4.91Polar Surface Area:
60.36HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.32DETAILS
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