| General Property |
| Molceule ID (DB) | EGIN0004165 |
| Inhibitor Class | Unknown |
| Molecule Name in Refrence Article | HTS02741 |
| IUPAC Name | ethyl 3-[(4-bromo-5-chlorothiophen-2-yl)sulfonamido]-4-(morpholin-4-yl)benzoate |
| Formula | C17H18BrClN2O5S2 |
| Mass | 509.822 |
| Exact Mass | 507.9529034 |
| Composition | C (40.05%), H (3.56%), Br (15.67%), Cl (6.95%), N (5.49%), O (15.69%), S (12.58%) |
| Atom Count | 46 |
| PI | 2.05 |
| Smiles | c1(c(ccc(c1)C(=O)OCC)N1CCOCC1)NS(=O)(=O)c1cc(c(s1)Cl)Br |
| InChI | 1S/C17H18BrClN2O5S2/c1-2-26-17(22)11-3-4-14(21-5-7-25-8-6-21)13(9-11)20-28(23,24)15-10-12(18)16(19)2
7-15/h3-4,9-10,20H,2,5-8H2,1H3 |
| InChIKey | QNBDIJUSIIMDQQ-UHFFFAOYSA-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 | 19170633 |
| 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 |
2810857
|
| Drug Bank Link | - |
| ChemSpider Link | 2089272 |
| ChEMBL Link | CHEMBL461782 |
