| General Property |
| Molceule ID (DB) | EGIN0004005 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5a compound |
| IUPAC Name | 6,7-diethoxy-2-methyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]quinazolin-4-amine |
| Formula | C23H24N4O2S |
| Mass | 420.527 |
| Exact Mass | 420.1619967 |
| Composition | C (65.69%), H (5.75%), N (13.32%), O (7.61%), S (7.62%) |
| Atom Count | 54 |
| PI | 10.86 |
| Smiles | c1(c2c(nc(n1)C)cc(c(c2)OCC)OCC)Nc1cc(c2nc(sc2)C)ccc1 |
| InChI | 1S/C23H24N4O2S/c1-5-28-21-11-18-19(12-22(21)29-6-2)24-14(3)25-23(18)27-17-9-7-8-16(10-17)20-13-30-15
(4)26-20/h7-13H,5-6H2,1-4H3,(H,24,25,27) |
| InChIKey | INMBKJSYCMSQID-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 |
10194617
|
| Drug Bank Link | - |
| ChemSpider Link | 8370117 |
| ChEMBL Link | CHEMBL128027 |
