| General Property |
| Molceule ID (DB) | EGIN0004456 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5m |
| IUPAC Name | 8-({4-[(4-chlorophenyl)methoxy]phenyl}amino)-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
| Formula | C29H28ClN5O4 |
| Mass | 546.017 |
| Exact Mass | 545.1829821 |
| Composition | C (63.79%), H (5.17%), Cl (6.49%), N (12.83%), O (11.72%) |
| Atom Count | 67 |
| PI | 11.5 |
| Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1ccc(cc1)OCc1ccc(cc1)Cl |
| InChI | 1S/C29H28ClN5O4/c30-21-4-2-20(3-5-21)18-38-23-8-6-22(7-9-23)33-28-24-16-26-27(17-25(24)31-19-32-28)3
9-29(36)35(26)11-1-10-34-12-14-37-15-13-34/h2-9,16-17,19H,1,10-15,18H2,(H,31,32,33) |
| InChIKey | JSGQKTYZIOFSIG-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 | 28519321 |
| ChEMBL Link | - |
