| General Property |
| Molceule ID (DB) | EGIN0004006 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5b compound |
| IUPAC Name | 6,7-diethoxy-2-ethyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]quinazolin-4-amine |
| Formula | C24H26N4O2S |
| Mass | 434.554 |
| Exact Mass | 434.1776468 |
| Composition | C (66.33%), H (6.03%), N (12.89%), O (7.36%), S (7.38%) |
| Atom Count | 57 |
| PI | 10.75 |
| Smiles | c1(c2c(nc(n1)CC)cc(c(c2)OCC)OCC)Nc1cc(c2nc(sc2)C)ccc1 |
| InChI | 1S/C24H26N4O2S/c1-5-23-27-19-13-22(30-7-3)21(29-6-2)12-18(19)24(28-23)26-17-10-8-9-16(11-17)20-14-31
-15(4)25-20/h8-14H,5-7H2,1-4H3,(H,26,27,28) |
| InChIKey | JXZOGXXITGINEQ-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 | 12190310 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | F16BP | |
| Pub Chem Link |
10127271
|
| Drug Bank Link | - |
| ChemSpider Link | 8302790 |
| ChEMBL Link | CHEMBL126483 |
