| General Property |
| Molceule ID (DB) | EGIN0003870 |
| Inhibitor Class | Pyrido-thieno-pyrimidine |
| Molecule Name in Refrence Article | 75 compound |
| IUPAC Name | N-(3-bromophenyl)-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-amine |
| Formula | C15H9BrN4S |
| Mass | 357.228 |
| Exact Mass | 355.9731296 |
| Composition | C (50.43%), H (2.54%), Br (22.37%), N (15.68%), S (8.98%) |
| Atom Count | 30 |
| PI | 8.07 |
| Smiles | c12sc3c(c1ncnc2Nc1cc(Br)ccc1)cccn3 |
| InChI | 1S/C15H9BrN4S/c16-9-3-1-4-10(7-9)20-14-13-12(18-8-19-14)11-5-2-6-17-15(11)21-13/h1-8H,(H,18,19,20) |
| InChIKey | ZGFNQDIBQOZEFU-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 | 10639288 |
| 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 |
5328423
|
| Drug Bank Link | - |
| ChemSpider Link | 4485588 |
| ChEMBL Link | CHEMBL153409 |
