| BioID | bio199553 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1819393 |
|---|
| Molecular Formula | C29H34O4 |
|---|
| Molecular Weight | 446.59 |
|---|
| Molecular Weight (Monoisotopic) | 446.2457 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(2,3-Diphenethoxybenzyl)Hexanoic Acid |
|---|
| Smiles | CCCCC(Cc1cccc(OCCc2ccccc2)c1OCCc1ccccc1)C(=O)O |
|---|
| Inchi | InChI=1S/C29H34O4/c1-2-3-15-26(29(30)31)22-25-16-10-17-27(32-20-18-23-11-6-4-7-12-23)28(25)33-21-19-24-13-8-5-9-14-24/h4-14,16-17,26H,2-3,15,18-22H2,1H3,(H,30,31) |
|---|
| Inchi Key | YDHGSYFSHRPUIJ-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 12.0 |
|---|
| Bioactivities | 15.0 |
|---|
| Np Likeness Score | 0.02 |
|---|
| Records Key | ['11', '25'] |
|---|
| Records Name | ['2-(2,3-diphenethoxybenzyl)hexanoic acid', '2-(2,3-diphenethoxybenzyl)hexanoic acid'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
