General Information of the Compound
| Compound ID |
CP0458125
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-(4-methoxybenzoyl)-1-(2-morpholin-4-ylethyl)indol-5-yl]oxyacetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H26N2O6
|
||||||||||||||||||
| Molecular Weight |
438.48
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)C(=O)c1cn(CCN2CCOCC2)c2ccc(OCC(O)=O)cc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H26N2O6/c1-30-18-4-2-17(3-5-18)24(29)21-15-26(9-8-25-10-12-31-13-11-25)22-7-6-19(14-20(21)22)32-16-23(27)28/h2-7,14-15H,8-13,16H2,1H3,(H,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DOLUGRHYMLZFFF-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2