| General Property |
| Molceule ID (DB) | EGIN0001953 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | [(2R)-4-(6,7-dimethoxyquinazolin-4-yl)-2-methyl-1-phenylbutan-2-yl]diethylamine |
| Formula | C25H33N3O2 |
| Mass | 407.5484 |
| Exact Mass | 407.2572773 |
| Composition | C (73.68%), H (8.16%), N (10.31%), O (7.85%) |
| Atom Count | 63 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc2c(c1)c(ncn2)CC[C@@](Cc1ccccc1)(C)N(CC)CC)OC)OC |
| InChI | 1S/C25H33N3O2/c1-6-28(7-2)25(3,17-19-11-9-8-10-12-19)14-13-21-20-15-23(29-4)24(30-5)16-22(20)27-18-2
6-21/h8-12,15-16,18H,6-7,13-14,17H2,1-5H3/t25-/m1/s1 |
| InChIKey | MDJYMMSITXOPCM-RUZDIDTESA-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 | 17869510 |
| 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 | 23306766 |
| ChEMBL Link | CHEMBL398961 |
