| General Property |
| Molceule ID (DB) | EGIN0004532 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 3c |
| IUPAC Name | ol |
| Formula | C24H26ClFN5O2 |
| Mass | 470.947 |
| Exact Mass | 470.175906 |
| Composition | C (61.21%), H (5.56%), Cl (7.53%), F (4.03%), N (14.87%), O (6.79%) |
| Atom Count | 59 |
| PI | 8.89 |
| Smiles | c1c(ccc2c1c(ncn2)Nc1cc(c(cc1)F)Cl)NC(=O)C1CC(N(C(C1)(C)C)[O])(C)C |
| InChI | 1S/C24H26ClFN5O2/c1-23(2)11-14(12-24(3,4)31(23)33)22(32)30-15-6-8-20-17(9-15)21(28-13-27-20)29-16-5-
7-19(26)18(25)10-16/h5-10,13-14H,11-12H2,1-4H3,(H,30,32)(H,27,28,29) |
| InChIKey | IOVAIZPMGLENIU-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 | 22309911 |
| 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 |
57381324
|
| Drug Bank Link | - |
| ChemSpider Link | 28431372 |
| ChEMBL Link | CHEMBL1947124 |
