| General Property |
| Molceule ID (DB) | EGIN0002613 |
| Inhibitor Class | Hydroxybiphenyl |
| Molecule Name in Refrence Article | 13 compound |
| IUPAC Name | (2R)-2,4,4-trimethylpentyl 4-[2-(methoxymethoxy)-4-phenylphenyl]benzoate |
| Formula | C29H34O4 |
| Mass | 446.5779 |
| Exact Mass | 446.2457096 |
| Composition | C (78%), H (7.67%), O (14.33%) |
| Atom Count | 67 |
| PI | No isoelectric point. |
| Smiles | c1cccc(c1)c1ccc(c(c1)OCOC)c1ccc(cc1)C(=O)OC[C@H](C)CC(C)(C)C |
| InChI | 1S/C29H34O4/c1-21(18-29(2,3)4)19-32-28(30)24-13-11-23(12-14-24)26-16-15-25(17-27(26)33-20-31-5)22-9-
7-6-8-10-22/h6-17,21H,18-20H2,1-5H3/t21-/m1/s1 |
| InChIKey | NRDZJCPQCVQANM-OAQYLSRUSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| View Structure in Jmol | Click to view 3 d structure Download Mol File |
| Drug Like Property | Druglikeliness |
| Symmetry & Geometry | Symmetry And Geometrical Information |
| Activity & Binding | Activity against isoform and covalant binding information |
| Topological Properties | Descriptors |
| Reference | 7473597 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 9972314 |
| ChEMBL Link | CHEMBL141705 |
