| General Property |
| Molceule ID (DB) | EGIN0004450 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5y |
| IUPAC Name | 8-({3-chloro-4-[(4-chlorophenyl)methoxy]phenyl}amino)-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
| Formula | C29H27Cl2N5O4 |
| Mass | 580.462 |
| Exact Mass | 579.1440098 |
| Composition | C (60.01%), H (4.69%), Cl (12.22%), N (12.07%), O (11.03%) |
| Atom Count | 67 |
| PI | 11.3 |
| Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1cc(c(cc1)OCc1ccc(cc1)Cl)Cl |
| InChI | 1S/C29H27Cl2N5O4/c30-20-4-2-19(3-5-20)17-39-26-7-6-21(14-23(26)31)34-28-22-15-25-27(16-24(22)32-18-3
3-28)40-29(37)36(25)9-1-8-35-10-12-38-13-11-35/h2-7,14-16,18H,1,8-13,17H2,(H,32,33,34) |
| InChIKey | CNNHXKTUHSHSAU-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 28522472 |
| ChEMBL Link | - |
