General Information of the Compound
| Compound ID |
CP0421000
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[2-[[5-methyl-2-(2-methyl-1-benzofuran-5-yl)imidazol-1-yl]methyl]phenoxy]hexanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H28N2O4
|
||||||||||||||||||
| Molecular Weight |
432.52
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc2cc(ccc2o1)-c1ncc(C)n1Cc1ccccc1OCCCCCC(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H28N2O4/c1-18-16-27-26(20-11-12-24-22(15-20)14-19(2)32-24)28(18)17-21-8-5-6-9-23(21)31-13-7-3-4-10-25(29)30/h5-6,8-9,11-12,14-16H,3-4,7,10,13,17H2,1-2H3,(H,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AUWIMRZAPWIYPE-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