| General Property |
| Molceule ID (DB) | EGIN0004888 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 25 |
| IUPAC Name | 6-[(1H-indol-2-yl)carbonyl]-N-(3-iodophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C21H14IN5O |
| Mass | 479.2732 |
| Exact Mass | 479.0243035 |
| Composition | C (52.63%), H (2.94%), I (26.48%), N (14.61%), O (3.34%) |
| Atom Count | 42 |
| PI | 7.91 |
| Smiles | Ic1cccc(Nc2c3cc([nH]c3ncn2)C(=O)c2cc3ccccc3[nH]2)c1 |
| InChI | 1S/C21H14IN5O/c22-13-5-3-6-14(9-13)25-20-15-10-18(27-21(15)24-11-23-20)19(28)17-8-12-4-1-2-7-16(12)2
6-17/h1-11,26H,(H2,23,24,25,27) |
| InChIKey | VPJZOWPTJIQVFR-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 |
57390122
|
| Drug Bank Link | - |
| ChemSpider Link | 28491948 |
| ChEMBL Link | CHEMBL1928294 |
