General Information of the Compound
| Compound ID |
CP0516875
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[1-[4-[[6-[3-(cyclopropylmethoxy)phenoxy]pyridin-3-yl]methoxy]phenyl]ethyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H28N2O4
|
||||||||||||||||||
| Molecular Weight |
432.52
|
||||||||||||||||||
| Canonical SMILES |
CC(NC(C)=O)c1ccc(OCc2ccc(Oc3cccc(OCC4CC4)c3)nc2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H28N2O4/c1-18(28-19(2)29)22-9-11-23(12-10-22)30-17-21-8-13-26(27-15-21)32-25-5-3-4-24(14-25)31-16-20-6-7-20/h3-5,8-15,18,20H,6-7,16-17H2,1-2H3,(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RCIYLIQKUICBRR-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01270, Acetyl-CoA carboxylase 1
Protein ID: PT01119, Acetyl-CoA carboxylase 2