| General Property |
| Molceule ID (DB) | EGIN0003678 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 5w compound |
| IUPAC Name | N-(3-bromophenyl)-6-(4-methylpiperazin-1-yl)pyrido[3,4-d]pyrimidin-4-amine |
| Formula | C18H19BrN6 |
| Mass | 399.288 |
| Exact Mass | 398.0854573 |
| Composition | C (54.14%), H (4.8%), Br (20.01%), N (21.05%) |
| Atom Count | 44 |
| PI | 11.3 |
| Smiles | c12c(ncnc2cnc(N2CCN(CC2)C)c1)Nc1cc(Br)ccc1 |
| InChI | 1S/C18H19BrN6/c1-24-5-7-25(8-6-24)17-10-15-16(11-20-17)21-12-22-18(15)23-14-4-2-3-13(19)9-14/h2-4,9-
12H,5-8H2,1H3,(H,21,22,23) |
| InChIKey | FTYUEIQBPIWEPZ-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 | 4485534 |
| ChEMBL Link | CHEMBL162719 |
