| General Property |
| Molceule ID (DB) | EGIN0004892 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 29 |
| IUPAC Name | N-{2-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-6-[(1H-indol-2-yl)carbonyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C28H19ClFN5O2 |
| Mass | 511.934 |
| Exact Mass | 511.1211308 |
| Composition | C (65.69%), H (3.74%), Cl (6.93%), F (3.71%), N (13.68%), O (6.25%) |
| Atom Count | 56 |
| PI | 7.5 |
| Smiles | Fc1cccc(COc2cc(Cl)c(Nc3c4cc([nH]c4ncn3)C(=O)c3cc4ccccc4[nH]3)cc2)c1 |
| InChI | 1S/C28H19ClFN5O2/c29-21-12-19(37-14-16-4-3-6-18(30)10-16)8-9-23(21)34-27-20-13-25(35-28(20)32-15-31-
27)26(36)24-11-17-5-1-2-7-22(17)33-24/h1-13,15,33H,14H2,(H2,31,32,34,35) |
| InChIKey | DJGFXKQXYXBLCL-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 |
57402378
|
| Drug Bank Link | - |
| ChemSpider Link | 28431604 |
| ChEMBL Link | CHEMBL1928300 |
