| General Property |
| Molceule ID (DB) | EGIN0001850 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-5-methoxyquinazolin-4-amine |
| Formula | C21H17ClN4O2 |
| Mass | 392.838 |
| Exact Mass | 392.1040035 |
| Composition | C (64.21%), H (4.36%), Cl (9.02%), N (14.26%), O (8.15%) |
| Atom Count | 45 |
| PI | 10.02 |
| Smiles | c1(c2c(ncn1)cccc2OC)Nc1cc(c(OCc2ncccc2)cc1)Cl |
| InChI | 1S/C21H17ClN4O2/c1-27-19-7-4-6-17-20(19)21(25-13-24-17)26-14-8-9-18(16(22)11-14)28-12-15-5-2-3-10-23
-15/h2-11,13H,12H2,1H3,(H,24,25,26) |
| InChIKey | URQBZIUFPRGLCE-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 | 16055332 |
| 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 |
44403436
|
| Drug Bank Link | - |
| ChemSpider Link | 23261685 |
| ChEMBL Link | CHEMBL194389 |
