| General Property |
| Molceule ID (DB) | EGIN0002422 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 7 compound |
| IUPAC Name | 4-N-(3-bromophenyl)-6-[(2,4-dichlorophenyl)methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine |
| Formula | C19H14BrCl2N5 |
| Mass | 463.158 |
| Exact Mass | 460.9809635 |
| Composition | C (49.27%), H (3.05%), Br (17.25%), Cl (15.31%), N (15.12%) |
| Atom Count | 41 |
| PI | 10.23 |
| Smiles | n1c(nc2c(c1Nc1cccc(c1)Br)cc([nH]2)Cc1ccc(cc1Cl)Cl)N |
| InChI | 1S/C19H14BrCl2N5/c20-11-2-1-3-13(7-11)24-17-15-9-14(25-18(15)27-19(23)26-17)6-10-4-5-12(21)8-16(10)2
2/h1-5,7-9H,6H2,(H4,23,24,25,26,27) |
| InChIKey | KKIBGZAKMLYCDQ-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 | 20403700 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR1 | PDGFR beta | VEGFR2 | ALL |
| Pub Chem Link |
3008956
|
| Drug Bank Link | - |
| ChemSpider Link | 2278381 |
| ChEMBL Link | CHEMBL1095761 |
