| General Property |
| Molceule ID (DB) | EGIN0000261 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 2b compound |
| IUPAC Name | N-(3-bromophenyl)-1-methyl-1H-pyrazolo[4,3-g]quinazolin-5-amine |
| Formula | C16H12BrN5 |
| Mass | 354.204 |
| Exact Mass | 353.0276081 |
| Composition | C (54.25%), H (3.41%), Br (22.56%), N (19.77%) |
| Atom Count | 34 |
| PI | 9.5 |
| Smiles | c12c(cc3c(c1)cnn3C)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C16H12BrN5/c1-22-15-7-14-13(5-10(15)8-20-22)16(19-9-18-14)21-12-4-2-3-11(17)6-12/h2-9H,1H3,(H,18,
19,21) |
| InChIKey | BBWYQCNFQUTQED-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 |
5328280
|
| Drug Bank Link | - |
| ChemSpider Link | 4485445 |
| ChEMBL Link | CHEMBL39320 |
