| General Property |
| Molceule ID (DB) | EGIN0001822 |
| Inhibitor Class | Thieno-pyridine |
| Molecule Name in Refrence Article | 47 compound |
| IUPAC Name | 3-{[(4-{7-[(1H-indol-5-yl)amino]thieno[3,2-b]pyridin-2-yl}phenyl)methyl]amino}propan-1-ol |
| Formula | C25H24N4OS |
| Mass | 428.549 |
| Exact Mass | 428.1670821 |
| Composition | C (70.07%), H (5.64%), N (13.07%), O (3.73%), S (7.48%) |
| Atom Count | 55 |
| PI | 12.57 |
| Smiles | s1c(cc2c1c(Nc1cc3c([nH]cc3)cc1)ccn2)c1ccc(cc1)CNCCCO |
| InChI | 1S/C25H24N4OS/c30-13-1-10-26-16-17-2-4-18(5-3-17)24-15-23-25(31-24)22(9-12-28-23)29-20-6-7-21-19(14-
20)8-11-27-21/h2-9,11-12,14-15,26-27,30H,1,10,13,16H2,(H,28,29) |
| InChIKey | MDSJWBBQCSEPDO-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 | 14684289 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR | |
| Pub Chem Link |
18383007
|
| Drug Bank Link | - |
| ChemSpider Link | 13367615 |
| ChEMBL Link | CHEMBL77452 |
