| General Property |
| Molceule ID (DB) | EGIN0001432 |
| Inhibitor Class | Thieno-pyrimidine |
| Molecule Name in Refrence Article | 26 compound |
| IUPAC Name | N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-6-(1H-pyrrol-2-yl)thieno[3,2-d]pyrimidin-4-amine |
| Formula | C23H16ClFN4OS |
| Mass | 450.916 |
| Exact Mass | 450.0717378 |
| Composition | C (61.26%), H (3.58%), Cl (7.86%), F (4.21%), N (12.43%), O (3.55%), S (7.11%) |
| Atom Count | 47 |
| PI | 8.67 |
| Smiles | c1c(cc(c(c1)OCc1cc(ccc1)F)Cl)Nc1c2c(ncn1)cc(s2)c1ccc[nH]1 |
| InChI | 1S/C23H16ClFN4OS/c24-17-10-16(6-7-20(17)30-12-14-3-1-4-15(25)9-14)29-23-22-19(27-13-28-23)11-21(31-2
2)18-5-2-8-26-18/h1-11,13,26H,12H2,(H,27,28,29) |
| InChIKey | WVBOSBMDZYIKPK-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 | 19111461 |
| 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 | 24695868 |
| ChEMBL Link | CHEMBL473436 |
