| General Property |
| Molceule ID (DB) | EGIN0004834 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 7 |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}-3-(morpholin-4-yl)propanamide |
| Formula | C21H22BrN5O2 |
| Mass | 456.336 |
| Exact Mass | 455.0956876 |
| Composition | C (55.27%), H (4.86%), Br (17.51%), N (15.35%), O (7.01%) |
| Atom Count | 51 |
| PI | 10.48 |
| Smiles | c1c(ccc2c1c(ncn2)Nc1cccc(c1)Br)NC(=O)CCN1CCOCC1 |
| InChI | 1S/C21H22BrN5O2/c22-15-2-1-3-16(12-15)26-21-18-13-17(4-5-19(18)23-14-24-21)25-20(28)6-7-27-8-10-29-1
1-9-27/h1-5,12-14H,6-11H2,(H,25,28)(H,23,24,26) |
| InChIKey | QXXYOYCCHAEKLL-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 |
10671481
|
| Drug Bank Link | - |
| ChemSpider Link | 8846833 |
| ChEMBL Link | - |
