| General Property |
| Molceule ID (DB) | EGIN0003983 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 2c compound |
| IUPAC Name | N-[3-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-6,7-diethoxyquinazolin-4-amine |
| Formula | C24H24N4O2S |
| Mass | 432.538 |
| Exact Mass | 432.1619967 |
| Composition | C (66.64%), H (5.59%), N (12.95%), O (7.4%), S (7.41%) |
| Atom Count | 55 |
| PI | 10.29 |
| Smiles | c12c(ncnc1cc(c(c2)OCC)OCC)Nc1cc(c2nc(sc2)C2CC2)ccc1 |
| InChI | 1S/C24H24N4O2S/c1-3-29-21-11-18-19(12-22(21)30-4-2)25-14-26-23(18)27-17-7-5-6-16(10-17)20-13-31-24(2
8-20)15-8-9-15/h5-7,10-15H,3-4,8-9H2,1-2H3,(H,25,26,27) |
| InChIKey | KJDHIZITJXZCHR-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 |
10173483
|
| Drug Bank Link | - |
| ChemSpider Link | 8348988 |
| ChEMBL Link | CHEMBL127458 |
