| General Property |
| Molceule ID (DB) | EGIN0002049 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 18 compound |
| IUPAC Name | 4-N-(4-chlorophenyl)-6-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine |
| Formula | C20H18ClN5 |
| Mass | 363.843 |
| Exact Mass | 363.1250733 |
| Composition | C (66.02%), H (4.99%), Cl (9.74%), N (19.25%) |
| Atom Count | 44 |
| PI | 10.46 |
| Smiles | c1c(ccc(c1)Cl)Nc1c2c([nH]c(c2)CCc2ccccc2)nc(N)n1 |
| InChI | 1S/C20H18ClN5/c21-14-7-10-15(11-8-14)23-18-17-12-16(24-19(17)26-20(22)25-18)9-6-13-4-2-1-3-5-13/h1-5
,7-8,10-12H,6,9H2,(H4,22,23,24,25,26) |
| InChIKey | ATKPRIDFHGQMAQ-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 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR1 | VEGFR2 | PDGFR beta | ALL |
| Pub Chem Link |
44586528
|
| Drug Bank Link | - |
| ChemSpider Link | 24717916 |
| ChEMBL Link | CHEMBL519147 |
