| General Property |
| Molceule ID (DB) | EGIN0001307 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | 4-N-{1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl}-5-[(E)-N-(4-methoxyphenyl)carboximidoyl]pyrimidine-4,6-diamine |
| Formula | C26H22FN7O |
| Mass | 467.4976 |
| Exact Mass | 467.1869866 |
| Composition | C (66.8%), H (4.74%), F (4.06%), N (20.97%), O (3.42%) |
| Atom Count | 57 |
| PI | 10.45 |
| Smiles | n1(c2c(cn1)cc(cc2)Nc1c(c(ncn1)N)/C=N/c1ccc(cc1)OC)Cc1cc(ccc1)F |
| InChI | 1S/C26H22FN7O/c1-35-22-8-5-20(6-9-22)29-14-23-25(28)30-16-31-26(23)33-21-7-10-24-18(12-21)13-32-34(2
4)15-17-3-2-4-19(27)11-17/h2-14,16H,15H2,1H3,(H3,28,30,31,33)/b29-14+ |
| InChIKey | DRLWGTWSWZETCV-IPPBACCNSA-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 | 18653333 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 24720650 |
| ChEMBL Link | CHEMBL525725 |
