| General Property |
| Molceule ID (DB) | EGIN0004824 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 8 |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}-3-(4-methylpiperazin-1-yl)propanamide |
| Formula | C22H25BrN6O |
| Mass | 469.378 |
| Exact Mass | 468.1273221 |
| Composition | C (56.29%), H (5.37%), Br (17.02%), N (17.9%), O (3.41%) |
| Atom Count | 55 |
| PI | 11.22 |
| Smiles | c1c(ccc2c1c(ncn2)Nc1cccc(c1)Br)NC(=O)CCN1CCN(CC1)C |
| InChI | 1S/C22H25BrN6O/c1-28-9-11-29(12-10-28)8-7-21(30)26-18-5-6-20-19(14-18)22(25-15-24-20)27-17-4-2-3-16(
23)13-17/h2-6,13-15H,7-12H2,1H3,(H,26,30)(H,24,25,27) |
| InChIKey | ZCAVBCPDPBXUJS-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 |
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| Drug Bank Link | - |
| ChemSpider Link | 28511565 |
| ChEMBL Link | - |
