| General Property |
| Molceule ID (DB) | EGIN0004898 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 35 |
| IUPAC Name | 6-[(1H-indol-2-yl)carbonyl]-N-(3-iodophenyl)thieno[2,3-d]pyrimidin-4-amine |
| Formula | C21H13IN4OS |
| Mass | 496.324 |
| Exact Mass | 495.9854752 |
| Composition | C (50.82%), H (2.64%), I (25.57%), N (11.29%), O (3.22%), S (6.46%) |
| Atom Count | 41 |
| PI | 7.35 |
| Smiles | Ic1cccc(Nc2c3cc(sc3ncn2)C(=O)c2cc3ccccc3[nH]2)c1 |
| InChI | 1S/C21H13IN4OS/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 | MHAGHCPUCHCZCI-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 |
57391901
|
| Drug Bank Link | - |
| ChemSpider Link | 28430072 |
| ChEMBL Link | CHEMBL1928295 |
