| General Property |
| Molceule ID (DB) | EGIN0001945 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 2e compound |
| IUPAC Name | N-[4-(6,7-dimethoxyquinazolin-4-yl)-2-methylbut-3-yn-2-yl]-N-methylaniline |
| Formula | C22H23N3O2 |
| Mass | 361.4369 |
| Exact Mass | 361.179027 |
| Composition | C (73.11%), H (6.41%), N (11.63%), O (8.85%) |
| Atom Count | 50 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc2c(c1)c(ncn2)C#CC(C)(C)N(c1ccccc1)C)OC)OC |
| InChI | 1S/C22H23N3O2/c1-22(2,25(3)16-9-7-6-8-10-16)12-11-18-17-13-20(26-4)21(27-5)14-19(17)24-15-23-18/h6-1
0,13-15H,1-5H3 |
| InChIKey | BQXIAZSINPRHQQ-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 | 17869510 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
44442170
|
| Drug Bank Link | - |
| ChemSpider Link | 23306758 |
| ChEMBL Link | CHEMBL250524 |
