| General Property |
| Molceule ID (DB) | EGIN0001949 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 2i compound |
| IUPAC Name | [(2S)-4-(6,7-dimethoxyquinazolin-4-yl)-2-phenylbut-3-yn-2-yl]diethylamine |
| Formula | C24H27N3O2 |
| Mass | 389.4901 |
| Exact Mass | 389.2103271 |
| Composition | C (74.01%), H (6.99%), N (10.79%), O (8.22%) |
| Atom Count | 56 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc2c(c1)c(ncn2)C#C[C@@](C)(N(CC)CC)c1ccccc1)OC)OC |
| InChI | 1S/C24H27N3O2/c1-6-27(7-2)24(3,18-11-9-8-10-12-18)14-13-20-19-15-22(28-4)23(29-5)16-21(19)26-17-25-2
0/h8-12,15-17H,6-7H2,1-5H3/t24-/m1/s1 |
| InChIKey | JISATZHCUTWAMQ-XMMPIXPASA-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 |
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| Drug Bank Link | - |
| ChemSpider Link | 23306762 |
| ChEMBL Link | CHEMBL250725 |
