| General Property |
| Molceule ID (DB) | EGIN0002039 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 8 compound |
| IUPAC Name | 4-N-(3-bromophenyl)-6-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine |
| Formula | C20H18BrN5 |
| Mass | 408.294 |
| Exact Mass | 407.0745582 |
| Composition | C (58.83%), H (4.44%), Br (19.57%), N (17.15%) |
| Atom Count | 44 |
| PI | 10.46 |
| Smiles | n1c(nc2c(c1Nc1cc(ccc1)Br)cc([nH]2)CCc1ccccc1)N |
| InChI | 1S/C20H18BrN5/c21-14-7-4-8-15(11-14)23-18-17-12-16(24-19(17)26-20(22)25-18)10-9-13-5-2-1-3-6-13/h1-8
,11-12H,9-10H2,(H4,22,23,24,25,26) |
| InChIKey | IDPINEYUDSPLGM-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 | 18467105 | 20403693 | |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | PDGFR beta | VEGFR1 | ALL |
| Pub Chem Link |
44586449
|
| Drug Bank Link | - |
| ChemSpider Link | 24703097 |
| ChEMBL Link | CHEMBL485320 |
