| General Property |
| Molceule ID (DB) | EGIN0004778 |
| Inhibitor Class | Unknown |
| Molecule Name in Refrence Article | 13 |
| IUPAC Name | N-(2-chlorophenyl)-2-{[5,6-dimethyl-3-(4-methylphenyl)-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Formula | C23H20ClN3O2S2 |
| Mass | 470.007 |
| Exact Mass | 469.068546 |
| Composition | C (58.77%), H (4.29%), Cl (7.54%), N (8.94%), O (6.81%), S (13.64%) |
| Atom Count | 51 |
| PI | 7.13 |
| Smiles | c1c(ccc(c1)n1c(=O)c2c(c(sc2nc1SCC(=O)Nc1ccccc1Cl)C)C)C |
| InChI | 1S/C23H20ClN3O2S2/c1-13-8-10-16(11-9-13)27-22(29)20-14(2)15(3)31-21(20)26-23(27)30-12-19(28)25-18-7-
5-4-6-17(18)24/h4-11H,12H2,1-3H3,(H,25,28) |
| InChIKey | FJGPPKWMLNVLAK-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 | 22227214 |
| 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 |
3138425
|
| Drug Bank Link | - |
| ChemSpider Link | 2390939 |
| ChEMBL Link | CHEMBL1944641 |
