| General Property |
| Molceule ID (DB) | EGIN0001840 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | 5d compound |
| IUPAC Name | N-(2-benzyl-1H-1,3-benzodiazol-5-yl)-4,6,8,9-tetraazatricyclo[7.4.0.0^{2,7}]trideca-1,3,5,7,10,12-hexaen-3-amine |
| Formula | C23H17N7 |
| Mass | 391.428 |
| Exact Mass | 391.1545436 |
| Composition | C (70.57%), H (4.38%), N (25.05%) |
| Atom Count | 47 |
| PI | 9.87 |
| Smiles | n1cnc2c(c1Nc1ccc3c(c1)nc([nH]3)Cc1ccccc1)c1n(n2)cccc1 |
| InChI | 1S/C23H17N7/c1-2-6-15(7-3-1)12-20-27-17-10-9-16(13-18(17)28-20)26-22-21-19-8-4-5-11-30(19)29-23(21)2
5-14-24-22/h1-11,13-14H,12H2,(H,27,28)(H,24,25,26,29) |
| InChIKey | IVNIGGUBKAEFHI-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 | 15993060 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | GSK-3 | VEGFR2 | ALL |
| Pub Chem Link |
11581908
|
| Drug Bank Link | - |
| ChemSpider Link | 9756674 |
| ChEMBL Link | CHEMBL361322 |
