| General Property |
| Molceule ID (DB) | EGIN0002409 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 21 compound |
| IUPAC Name | 6-(2-phenylethyl)-N-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C21H17F3N4 |
| Mass | 382.3817 |
| Exact Mass | 382.1405312 |
| Composition | C (65.96%), H (4.48%), F (14.91%), N (14.65%) |
| Atom Count | 45 |
| PI | 10 |
| Smiles | n1cnc2c(c1Nc1cc(ccc1)C(F)(F)F)cc([nH]2)CCc1ccccc1 |
| InChI | 1S/C21H17F3N4/c22-21(23,24)15-7-4-8-16(11-15)27-19-18-12-17(28-20(18)26-13-25-19)10-9-14-5-2-1-3-6-1
4/h1-8,11-13H,9-10H2,(H2,25,26,27,28) |
| InChIKey | PJUIFTJNPUTTFQ-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 | 20403693 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR1 | PDGFR beta | VEGFR2 | ALL |
| Pub Chem Link |
46887299
|
| Drug Bank Link | - |
| ChemSpider Link | 24671291 |
| ChEMBL Link | CHEMBL1097743 |
