| General Property |
| Molceule ID (DB) | EGIN0002390 |
| Inhibitor Class | Imidazo-thiazole |
| Molecule Name in Refrence Article | 19 compound |
| IUPAC Name | 3-{3-[5-(2-{[4-(morpholin-4-yl)phenyl]amino}pyrimidin-4-yl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-1-phenylurea |
| Formula | C32H28N8O2S |
| Mass | 588.682 |
| Exact Mass | 588.2055929 |
| Composition | C (65.29%), H (4.79%), N (19.03%), O (5.44%), S (5.45%) |
| Atom Count | 71 |
| PI | 7.22 |
| Smiles | c12nc(c(n1ccs2)c1ccnc(n1)Nc1ccc(cc1)N1CCOCC1)c1cc(ccc1)NC(=O)Nc1ccccc1 |
| InChI | 1S/C32H28N8O2S/c41-31(35-23-6-2-1-3-7-23)36-25-8-4-5-22(21-25)28-29(40-17-20-43-32(40)38-28)27-13-14
-33-30(37-27)34-24-9-11-26(12-10-24)39-15-18-42-19-16-39/h1-14,17,20-21H,15-16,18-19H2,(H,33,34,37)(
H2,35,36,41) |
| InChIKey | OUEPVFYERDPSQL-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 |
46886317
|
| Drug Bank Link | - |
| ChemSpider Link | 24675342 |
| ChEMBL Link | CHEMBL1090354 |
