| General Property |
| Molceule ID (DB) | EGIN0002480 |
| Inhibitor Class | Thieno-pyrimidine |
| Molecule Name in Refrence Article | 7a compound |
| IUPAC Name | N-(2-phenylethyl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-amine |
| Formula | C18H19N3S |
| Mass | 309.429 |
| Exact Mass | 309.1299683 |
| Composition | C (69.87%), H (6.19%), N (13.58%), S (10.36%) |
| Atom Count | 41 |
| PI | 11.55 |
| Smiles | c1(c2c(ncn1)sc1c2CCCC1)NCCc1ccccc1 |
| InChI | 1S/C18H19N3S/c1-2-6-13(7-3-1)10-11-19-17-16-14-8-4-5-9-15(14)22-18(16)21-12-20-17/h1-3,6-7,12H,4-5,8
-11H2,(H,19,20,21) |
| InChIKey | JIAZAZLJYAUUKH-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 | 20961149 |
| 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 |
830964
|
| Drug Bank Link | - |
| ChemSpider Link | 725757 |
| ChEMBL Link | CHEMBL1271896 |
