| General Property |
| Molceule ID (DB) | EGIN0004905 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 42 |
| IUPAC Name | N-(3-chlorophenyl)-6-[(1H-indol-2-yl)carbonyl]thieno[2,3-d]pyrimidin-4-amine |
| Formula | C21H13ClN4OS |
| Mass | 404.872 |
| Exact Mass | 404.0498595 |
| Composition | C (62.3%), H (3.24%), Cl (8.76%), N (13.84%), O (3.95%), S (7.92%) |
| Atom Count | 41 |
| PI | 7.35 |
| Smiles | Clc1cccc(Nc2c3cc(sc3ncn2)C(=O)c2cc3ccccc3[nH]2)c1 |
| InChI | 1S/C21H13ClN4OS/c22-13-5-3-6-14(9-13)25-20-15-10-18(28-21(15)24-11-23-20)19(27)17-8-12-4-1-2-7-16(12
)26-17/h1-11,26H,(H,23,24,25) |
| InChIKey | YGSAZOCXJDIJLN-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 | 22169601 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | |
| Pub Chem Link |
56839586
|
| Drug Bank Link | - |
| ChemSpider Link | 28429414 |
| ChEMBL Link | CHEMBL1928309 |
