| General Property |
| Molceule ID (DB) | EGIN0001279 |
| Inhibitor Class | Naphthyridine |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | (2E)-N-{5-[(3-bromophenyl)amino]-6-cyano-1,8-naphthyridin-3-yl}-4-(dimethylamino)but-2-enamide |
| Formula | C21H19BrN6O |
| Mass | 451.319 |
| Exact Mass | 450.0803719 |
| Composition | C (55.89%), H (4.24%), Br (17.7%), N (18.62%), O (3.55%) |
| Atom Count | 48 |
| PI | 10.83 |
| Smiles | c12c(ncc(c1)NC(=O)/C=C/CN(C)C)ncc(c2Nc1cc(ccc1)Br)C#N |
| InChI | 1S/C21H19BrN6O/c1-28(2)8-4-7-19(29)26-17-10-18-20(27-16-6-3-5-15(22)9-16)14(11-23)12-24-21(18)25-13-
17/h3-7,9-10,12-13H,8H2,1-2H3,(H,26,29)(H,24,25,27)/b7-4+ |
| InChIKey | JCGLOUUPTKEXIO-QPJJXVBHSA-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 | 15006373 |
| 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 |
44279647
|
| Drug Bank Link | - |
| ChemSpider Link | 23127807 |
| ChEMBL Link | CHEMBL441518 |
