| General Property |
| Molceule ID (DB) | EGIN0001186 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | N-{4-[(3-methylphenyl)amino]-7-{3-[(3S)-morpholin-3-yl]propoxy}quinazolin-6-yl}prop-2-enamide |
| Formula | C25H29N5O3 |
| Mass | 447.5295 |
| Exact Mass | 447.2270398 |
| Composition | C (67.09%), H (6.53%), N (15.65%), O (10.73%) |
| Atom Count | 62 |
| PI | 10.61 |
| Smiles | Cc1cccc(Nc2ncnc3cc(OCCC[C@H]4COCCN4)c(NC(=O)C=C)cc23)c1 |
| InChI | 1S/C25H29N5O3/c1-3-24(31)30-22-13-20-21(14-23(22)33-10-5-8-19-15-32-11-9-26-19)27-16-28-25(20)29-18-
7-4-6-17(2)12-18/h3-4,6-7,12-14,16,19,26H,1,5,8-11,15H2,2H3,(H,30,31)(H,27,28,29)/t19-/m0/s1 |
| InChIKey | MTIDBGYVJSGZCT-IBGZPJMESA-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 | 10956451 |
| 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 | - |
| ChEMBL Link | - |
