| General Property |
| Molceule ID (DB) | EGIN0003846 |
| Inhibitor Class | Benzo-thieno-pyrimidine |
| Molecule Name in Refrence Article | 51 compound |
| IUPAC Name | N-benzyl-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-amine |
| Formula | C17H13N3S |
| Mass | 291.37 |
| Exact Mass | 291.0830181 |
| Composition | C (70.08%), H (4.5%), N (14.42%), S (11%) |
| Atom Count | 34 |
| PI | 9.47 |
| Smiles | c12sc3c(c1ncnc2NCc1ccccc1)cccc3 |
| InChI | 1S/C17H13N3S/c1-2-6-12(7-3-1)10-18-17-16-15(19-11-20-17)13-8-4-5-9-14(13)21-16/h1-9,11H,10H2,(H,18,1
9,20) |
| InChIKey | XJRQKMJYHWKOOV-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 | FGFr | ALL |
| Pub Chem Link |
5328399
|
| Drug Bank Link | - |
| ChemSpider Link | 4485564 |
| ChEMBL Link | CHEMBL153419 |
