| General Property |
| Molceule ID (DB) | EGIN0000264 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 2f compound |
| IUPAC Name | N-(3-bromophenyl)-1-[2-(morpholin-4-yl)ethyl]-1H-pyrazolo[4,3-g]quinazolin-5-amine |
| Formula | C21H21BrN6O |
| Mass | 453.335 |
| Exact Mass | 452.096022 |
| Composition | C (55.64%), H (4.67%), Br (17.63%), N (18.54%), O (3.53%) |
| Atom Count | 50 |
| PI | 11.22 |
| Smiles | c12c(cc3c(c1)cnn3CCN1CCOCC1)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C21H21BrN6O/c22-16-2-1-3-17(11-16)26-21-18-10-15-13-25-28(5-4-27-6-8-29-9-7-27)20(15)12-19(18)23-
14-24-21/h1-3,10-14H,4-9H2,(H,23,24,26) |
| InChIKey | ZNHHYTFVIUDETO-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 |
5328283
|
| Drug Bank Link | - |
| ChemSpider Link | 4485448 |
| ChEMBL Link | CHEMBL38199 |
