| General Property |
| Molceule ID (DB) | EGIN0004795 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 11(Q:3,X:B) ,GW974 |
| IUPAC Name | 4-N-(1-benzyl-1H-indazol-5-yl)-6-N,6-N-dimethylpyrido[3,4-d]pyrimidine-4,6-diamine |
| Formula | C23H21N7 |
| Mass | 395.4597 |
| Exact Mass | 395.1858437 |
| Composition | C (69.85%), H (5.35%), N (24.79%) |
| Atom Count | 51 |
| PI | 9.96 |
| Smiles | c1c(ncc2c1c(ncn2)Nc1ccc2n(ncc2c1)Cc1ccccc1)N(C)C |
| InChI | 1S/C23H21N7/c1-29(2)22-11-19-20(13-24-22)25-15-26-23(19)28-18-8-9-21-17(10-18)12-27-30(21)14-16-6-4-
3-5-7-16/h3-13,15H,14H2,1-2H3,(H,25,26,28) |
| InChIKey | DYYZXRCFCVDSKD-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 | 11378364 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-erbB-2 | EGFr | c-erbB-4 | CDK1 | CDK2 | Mek | Src | Raf | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 5036165 |
| ChEMBL Link | CHEMBL30432 |
