| General Property |
| Molceule ID (DB) | EGIN0004853 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5 |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}-3-(dimethylamino)propanamide |
| Formula | C19H20BrN5O |
| Mass | 414.299 |
| Exact Mass | 413.0851229 |
| Composition | C (55.08%), H (4.87%), Br (19.29%), N (16.9%), O (3.86%) |
| Atom Count | 46 |
| PI | 11.52 |
| Smiles | c1c(ccc2c1c(ncn2)Nc1cccc(c1)Br)NC(=O)CCN(C)C |
| InChI | 1S/C19H20BrN5O/c1-25(2)9-8-18(26)23-15-6-7-17-16(11-15)19(22-12-21-17)24-14-5-3-4-13(20)10-14/h3-7,1
0-12H,8-9H2,1-2H3,(H,23,26)(H,21,22,24) |
| InChIKey | FGNHHQRGJTYKKZ-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 | 22280453 |
| 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 |
46239453
|
| Drug Bank Link | - |
| ChemSpider Link | 28506612 |
| ChEMBL Link | - |
