| General Property |
| Molceule ID (DB) | EGIN0002396 |
| Inhibitor Class | Imidazo-thiazole |
| Molecule Name in Refrence Article | 25 compound |
| IUPAC Name | 2,6-difluoro-N-[3-(5-{2-[(1,2,3,4-tetrahydroisoquinolin-6-yl)amino]pyrimidin-4-yl}imidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide |
| Formula | C31H23F2N7OS |
| Mass | 579.622 |
| Exact Mass | 579.1652855 |
| Composition | C (64.24%), H (4%), F (6.56%), N (16.92%), O (2.76%), S (5.53%) |
| Atom Count | 65 |
| PI | 9.5 |
| Smiles | c12nc(c(n1ccs2)c1ccnc(n1)Nc1ccc2c(c1)CCNC2)c1cc(ccc1)NC(=O)c1c(cccc1F)F |
| InChI | 1S/C31H23F2N7OS/c32-23-5-2-6-24(33)26(23)29(41)36-21-4-1-3-19(16-21)27-28(40-13-14-42-31(40)39-27)25
-10-12-35-30(38-25)37-22-8-7-20-17-34-11-9-18(20)15-22/h1-8,10,12-16,34H,9,11,17H2,(H,36,41)(H,35,37
,38) |
| InChIKey | UUFDRURWKKKAJF-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 |
46886322
|
| Drug Bank Link | - |
| ChemSpider Link | 24676801 |
| ChEMBL Link | CHEMBL1090359 |
