| General Property |
| Molceule ID (DB) | EGIN0004910 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 51 |
| IUPAC Name | N-(3-chloro-4-fluorophenyl)-6-[(1H-indol-2-yl)carbonyl]-N-methylthieno[2,3-d]pyrimidin-4-amine |
| Formula | C22H14ClFN4OS |
| Mass | 436.889 |
| Exact Mass | 436.0560877 |
| Composition | C (60.48%), H (3.23%), Cl (8.11%), F (4.35%), N (12.82%), O (3.66%), S (7.34%) |
| Atom Count | 44 |
| PI | 7.31 |
| Smiles | CN(c1cc(Cl)c(F)cc1)c1c2cc(sc2ncn1)C(=O)c1cc2ccccc2[nH]1 |
| InChI | 1S/C22H14ClFN4OS/c1-28(13-6-7-16(24)15(23)9-13)21-14-10-19(30-22(14)26-11-25-21)20(29)18-8-12-4-2-3-
5-17(12)27-18/h2-11,27H,1H3 |
| InChIKey | NTTSBRQVYORONV-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 | 22169601 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | |
| Pub Chem Link |
57400568
|
| Drug Bank Link | - |
| ChemSpider Link | 28429803 |
| ChEMBL Link | CHEMBL1928313 |
