| General Property |
| Molceule ID (DB) | EGIN0003690 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 9u compound |
| IUPAC Name | 6-N-[2-(1H-imidazol-4-yl)ethyl]-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine |
| Formula | C19H19N7 |
| Mass | 345.4011 |
| Exact Mass | 345.1701936 |
| Composition | C (66.07%), H (5.54%), N (28.39%) |
| Atom Count | 45 |
| PI | 10.54 |
| Smiles | c1(c2c(ncn1)cnc(c2)NCCc1nc[nH]c1)Nc1cc(ccc1)C |
| InChI | 1S/C19H19N7/c1-13-3-2-4-14(7-13)26-19-16-8-18(22-10-17(16)24-12-25-19)21-6-5-15-9-20-11-23-15/h2-4,7
-12H,5-6H2,1H3,(H,20,23)(H,21,22)(H,24,25,26) |
| InChIKey | HYWSAKRCBCFZNH-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 | 9513602 |
| 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 | 4485545 |
| ChEMBL Link | CHEMBL161895 |
