| General Property |
| Molceule ID (DB) | EGIN0004046 |
| Inhibitor Class | Thieno-pyrimidine |
| Molecule Name in Refrence Article | 76 compound |
| IUPAC Name | 3-(4-{4-aminothieno[2,3-d]pyrimidin-5-yl}phenyl)-1-(3-methylphenyl)urea |
| Formula | C20H17N5OS |
| Mass | 375.447 |
| Exact Mass | 375.1153809 |
| Composition | C (63.98%), H (4.56%), N (18.65%), O (4.26%), S (8.54%) |
| Atom Count | 44 |
| PI | 7.77 |
| Smiles | c1cc(ccc1NC(=O)Nc1cc(ccc1)C)c1csc2c1c(ncn2)N |
| InChI | 1S/C20H17N5OS/c1-12-3-2-4-15(9-12)25-20(26)24-14-7-5-13(6-8-14)16-10-27-19-17(16)18(21)22-11-23-19/h
2-11H,1H3,(H2,21,22,23)(H2,24,25,26) |
| InChIKey | DZSUJUOJJJCWGG-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 | 16162008 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Kit | c-Met | CSF1R | FGFR | FLT1 | FLT3 | FLT4 | KDR | LCK | PDGFR | Tie2 | ALL |
| Pub Chem Link |
6539985
|
| Drug Bank Link | - |
| ChemSpider Link | 5022385 |
| ChEMBL Link | CHEMBL196363 |
