| General Property |
| Molceule ID (DB) | EGIN0003848 |
| Inhibitor Class | Benzo-thieno-pyrimidine |
| Molecule Name in Refrence Article | 53 compound |
| IUPAC Name | N-(3-bromophenyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-amine |
| Formula | C16H10BrN3S |
| Mass | 356.24 |
| Exact Mass | 354.9778807 |
| Composition | C (53.94%), H (2.83%), Br (22.43%), N (11.8%), S (9%) |
| Atom Count | 31 |
| PI | 8 |
| Smiles | c12sc3c(c1ncnc2Nc1cc(Br)ccc1)cccc3 |
| InChI | 1S/C16H10BrN3S/c17-10-4-3-5-11(8-10)20-16-15-14(18-9-19-16)12-6-1-2-7-13(12)21-15/h1-9H,(H,18,19,20) |
| InChIKey | FNWRJIWVXKOMHC-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 | PKC | FGFr | ALL |
| Pub Chem Link |
5328401
|
| Drug Bank Link | - |
| ChemSpider Link | 4485566 |
| ChEMBL Link | CHEMBL356850 |
