| General Property |
| Molceule ID (DB) | EGIN0004838 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 6(Q:2,X:A) |
| IUPAC Name | N-(1-benzyl-1H-indol-5-yl)-6,7-dimethoxyquinazolin-4-amine |
| Formula | C25H22N4O2 |
| Mass | 410.4678 |
| Exact Mass | 410.174276 |
| Composition | C (73.15%), H (5.4%), N (13.65%), O (7.8%) |
| Atom Count | 53 |
| PI | 10.27 |
| Smiles | c1c(c(cc2c1c(ncn2)Nc1ccc2n(ccc2c1)Cc1ccccc1)OC)OC |
| InChI | 1S/C25H22N4O2/c1-30-23-13-20-21(14-24(23)31-2)26-16-27-25(20)28-19-8-9-22-18(12-19)10-11-29(22)15-17
-6-4-3-5-7-17/h3-14,16H,15H2,1-2H3,(H,26,27,28) |
| InChIKey | DIHYLNFJZYXPHB-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 | 11378364 |
| 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 | 23127821 |
| ChEMBL Link | CHEMBL31108 |
