| General Property |
| Molceule ID (DB) | EGIN0000664 |
| Inhibitor Class | Pyrimido-Pyrimidine |
| Molecule Name in Refrence Article | 6b compound |
| IUPAC Name | 8-N-(3-methylphenyl)-[1,3]diazino[5,4-d]pyrimidine-2,8-diamine |
| Formula | C13H12N6 |
| Mass | 252.2746 |
| Exact Mass | 252.1123444 |
| Composition | C (61.89%), H (4.79%), N (33.31%) |
| Atom Count | 31 |
| PI | 9.29 |
| Smiles | c12c(cnc(n1)N)ncnc2Nc1cccc(c1)C |
| InChI | 1S/C13H12N6/c1-8-3-2-4-9(5-8)18-12-11-10(16-7-17-12)6-15-13(14)19-11/h2-7H,1H3,(H2,14,15,19)(H,16,17
,18) |
| InChIKey | OLZKKHBEDMOWRD-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 | 9191958 |
| 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 |
5328345
|
| Drug Bank Link | - |
| ChemSpider Link | 4485510 |
| ChEMBL Link | CHEMBL298931 |
