| General Property |
| Molceule ID (DB) | EGIN0002423 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 8 compound |
| IUPAC Name | 4-N-(4-bromo-2-chlorophenyl)-6-[(2,4-dichlorophenyl)methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine |
| Formula | C19H13BrCl3N5 |
| Mass | 497.603 |
| Exact Mass | 494.9419912 |
| Composition | C (45.86%), H (2.63%), Br (16.06%), Cl (21.37%), N (14.07%) |
| Atom Count | 41 |
| PI | 9.81 |
| Smiles | c1(nc2c(c(n1)Nc1c(cc(cc1)Br)Cl)cc([nH]2)Cc1ccc(cc1Cl)Cl)N |
| InChI | 1S/C19H13BrCl3N5/c20-10-2-4-16(15(23)6-10)26-18-13-8-12(25-17(13)27-19(24)28-18)5-9-1-3-11(21)7-14(9
)22/h1-4,6-8H,5H2,(H4,24,25,26,27,28) |
| InChIKey | KLSFLISRKPNSSL-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 | PDGFR beta | VEGFR1 | VEGFR2 | ALL |
| Pub Chem Link |
46845026
|
| Drug Bank Link | - |
| ChemSpider Link | 24672173 |
| ChEMBL Link | CHEMBL1095762 |
