| General Property |
| Molceule ID (DB) | EGIN0002391 |
| Inhibitor Class | Imidazo-thiazole |
| Molecule Name in Refrence Article | 20 compound |
| IUPAC Name | phenyl N-{3-[5-(2-{[4-(morpholin-4-yl)phenyl]amino}pyrimidin-4-yl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}carbamate |
| Formula | C32H27N7O3S |
| Mass | 589.667 |
| Exact Mass | 589.1896085 |
| Composition | C (65.18%), H (4.62%), N (16.63%), O (8.14%), S (5.44%) |
| Atom Count | 70 |
| PI | 7.88 |
| Smiles | c12nc(c(n1ccs2)c1ccnc(n1)Nc1ccc(cc1)N1CCOCC1)c1cc(ccc1)NC(=O)Oc1ccccc1 |
| InChI | 1S/C32H27N7O3S/c40-32(42-26-7-2-1-3-8-26)35-24-6-4-5-22(21-24)28-29(39-17-20-43-31(39)37-28)27-13-14
-33-30(36-27)34-23-9-11-25(12-10-23)38-15-18-41-19-16-38/h1-14,17,20-21H,15-16,18-19H2,(H,35,40)(H,3
3,34,36) |
| InChIKey | VRTJYLZXQJQCPQ-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 |
46886318
|
| Drug Bank Link | - |
| ChemSpider Link | 24676790 |
| ChEMBL Link | CHEMBL1090355 |
