| General Property |
| Molceule ID (DB) | EGIN0001942 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 2b compound |
| IUPAC Name | 6,7-dimethoxy-4-(4-phenylbut-1-yn-1-yl)quinazoline |
| Formula | C20H18N2O2 |
| Mass | 318.3691 |
| Exact Mass | 318.1368278 |
| Composition | C (75.45%), H (5.7%), N (8.8%), O (10.05%) |
| Atom Count | 42 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc2c(c1)c(ncn2)C#CCCc1ccccc1)OC)OC |
| InChI | 1S/C20H18N2O2/c1-23-19-12-16-17(21-14-22-18(16)13-20(19)24-2)11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,12-1
4H,6,10H2,1-2H3 |
| InChIKey | UJTHKWFURJCQDD-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 | 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 |
44442165
|
| Drug Bank Link | - |
| ChemSpider Link | 23306753 |
| ChEMBL Link | CHEMBL250318 |
