| General Property |
| Molceule ID (DB) | EGIN0004458 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5k |
| IUPAC Name | 8-[(4-ethoxyphenyl)amino]-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
| Formula | C24H27N5O4 |
| Mass | 449.5023 |
| Exact Mass | 449.2063044 |
| Composition | C (64.13%), H (6.05%), N (15.58%), O (14.24%) |
| Atom Count | 60 |
| PI | 11.5 |
| Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1ccc(cc1)OCC |
| InChI | 1S/C24H27N5O4/c1-2-32-18-6-4-17(5-7-18)27-23-19-14-21-22(15-20(19)25-16-26-23)33-24(30)29(21)9-3-8-2
8-10-12-31-13-11-28/h4-7,14-16H,2-3,8-13H2,1H3,(H,25,26,27) |
| InChIKey | IVYMBPMGUJIIIK-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 | 22818848 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 28519319 |
| ChEMBL Link | - |
