| General Property |
| Molceule ID (DB) | EGIN0000270 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 3e compound |
| IUPAC Name | N-(3-bromophenyl)-8-[3-(dimethylamino)propyl]-8H-pyrrolo[3,2-g]quinazolin-4-amine |
| Formula | C21H22BrN5 |
| Mass | 424.337 |
| Exact Mass | 423.1058584 |
| Composition | C (59.44%), H (5.23%), Br (18.83%), N (16.5%) |
| Atom Count | 49 |
| PI | 12.6 |
| Smiles | N(C)(C)CCCn1c2cc3c(cc2cc1)c(ncn3)Nc1cccc(c1)Br |
| InChI | 1S/C21H22BrN5/c1-26(2)8-4-9-27-10-7-15-11-18-19(13-20(15)27)23-14-24-21(18)25-17-6-3-5-16(22)12-17/h
3,5-7,10-14H,4,8-9H2,1-2H3,(H,23,24,25) |
| InChIKey | KSESIAIRSPHRBJ-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 | 9154973 |
| 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 |
5328288
|
| Drug Bank Link | - |
| ChemSpider Link | 4485453 |
| ChEMBL Link | CHEMBL287289 |
