| General Property |
| Molceule ID (DB) | EGIN0002400 |
| Inhibitor Class | Imidazo-thiazole |
| Molecule Name in Refrence Article | 29 compound |
| IUPAC Name | N-(3-{5-[2-({3-[2-(dimethylamino)ethyl]phenyl}amino)pyrimidin-4-yl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)-2-phenylacetamide |
| Formula | C33H31N7OS |
| Mass | 573.711 |
| Exact Mass | 573.2310793 |
| Composition | C (69.09%), H (5.45%), N (17.09%), O (2.79%), S (5.59%) |
| Atom Count | 73 |
| PI | 11.15 |
| Smiles | c12nc(c(n1ccs2)c1ccnc(n1)Nc1cccc(c1)CCN(C)C)c1cc(ccc1)NC(=O)Cc1ccccc1 |
| InChI | 1S/C33H31N7OS/c1-39(2)17-15-24-10-6-12-26(20-24)36-32-34-16-14-28(37-32)31-30(38-33-40(31)18-19-42-3
3)25-11-7-13-27(22-25)35-29(41)21-23-8-4-3-5-9-23/h3-14,16,18-20,22H,15,17,21H2,1-2H3,(H,35,41)(H,34
,36,37) |
| InChIKey | JPSXZEQQHPNTNX-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 | 20346655 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | IGF1R | |
| Pub Chem Link |
46886326
|
| Drug Bank Link | - |
| ChemSpider Link | 24676802 |
| ChEMBL Link | CHEMBL1090363 |
