| General Property |
| Molceule ID (DB) | EGIN0003855 |
| Inhibitor Class | Benzo-thieno-pyrimidine |
| Molecule Name in Refrence Article | 60 compound |
| IUPAC Name | 6-N-[3-(trifluoromethyl)phenyl]-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene-6,12-diamine |
| Formula | C17H11F3N4S |
| Mass | 360.356 |
| Exact Mass | 360.0656517 |
| Composition | C (56.66%), H (3.08%), F (15.82%), N (15.55%), S (8.9%) |
| Atom Count | 36 |
| PI | 9.03 |
| Smiles | c12sc3c(c1ncnc2Nc1cc(C(F)(F)F)ccc1)cc(N)cc3 |
| InChI | 1S/C17H11F3N4S/c18-17(19,20)9-2-1-3-11(6-9)24-16-15-14(22-8-23-16)12-7-10(21)4-5-13(12)25-15/h1-8H,2
1H2,(H,22,23,24) |
| InChIKey | INSDTUVLNWKIRF-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 | PDGFr | c-Src | FGFr | PKC | ALL |
| Pub Chem Link |
5328408
|
| Drug Bank Link | - |
| ChemSpider Link | 4485573 |
| ChEMBL Link | CHEMBL347282 |
