| General Property |
| Molceule ID (DB) | EGIN0003979 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 26 compound |
| IUPAC Name | N-(4-cyanophenyl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide |
| Formula | C22H22N6O3 |
| Mass | 418.4485 |
| Exact Mass | 418.1753386 |
| Composition | C (63.15%), H (5.3%), N (20.08%), O (11.47%) |
| Atom Count | 53 |
| PI | 9.2 |
| Smiles | c12c(N3CCN(C(=O)Nc4ccc(C#N)cc4)CC3)ncnc1cc(c(c2)OC)OC |
| InChI | 1S/C22H22N6O3/c1-30-19-11-17-18(12-20(19)31-2)24-14-25-21(17)27-7-9-28(10-8-27)22(29)26-16-5-3-15(13
-23)4-6-16/h3-6,11-12,14H,7-10H2,1-2H3,(H,26,29) |
| InChIKey | SOTRSERIYXCWEZ-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 | 12086491 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | FGFR | CSF1R | ERK2 | Jnk1 | Mek1 | Mkk3 | Mkk6 | p38 | PKA | PKC | Src | Flt3 | PDGFR beta | c-Kit | PDGFR alpha | ALL |
| Pub Chem Link |
10905857
|
| Drug Bank Link | - |
| ChemSpider Link | 9081116 |
| ChEMBL Link | CHEMBL106966 |
