| General Property |
| Molceule ID (DB) | EGIN0002395 |
| Inhibitor Class | Imidazo-thiazole |
| Molecule Name in Refrence Article | 24 compound |
| IUPAC Name | N-{3-[5-(2-{[4-(4-ethylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-2,6-difluorobenzamide |
| Formula | C34H30F2N8OS |
| Mass | 636.717 |
| Exact Mass | 636.2231347 |
| Composition | C (64.14%), H (4.75%), F (5.97%), N (17.6%), O (2.51%), S (5.04%) |
| Atom Count | 76 |
| PI | 8.99 |
| Smiles | N(C(=O)c1c(cccc1F)F)c1cccc(c1)c1c(n2c(n1)scc2)c1ccnc(n1)Nc1ccc(N2CCN(CC2)CC)cc1 |
| InChI | 1S/C34H30F2N8OS/c1-2-42-15-17-43(18-16-42)25-11-9-23(10-12-25)39-33-37-14-13-28(40-33)31-30(41-34-44
(31)19-20-46-34)22-5-3-6-24(21-22)38-32(45)29-26(35)7-4-8-27(29)36/h3-14,19-21H,2,15-18H2,1H3,(H,38,
45)(H,37,39,40) |
| InChIKey | OPHRYHXTWRJEBA-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 | ALL |
| Pub Chem Link |
46886321
|
| Drug Bank Link | - |
| ChemSpider Link | 24675709 |
| ChEMBL Link | CHEMBL1090358 |
