| General Property |
| Molceule ID (DB) | EGIN0003003 |
| Inhibitor Class | Indole |
| Molecule Name in Refrence Article | 12 compound |
| IUPAC Name | 2-{5-[2-(4-methoxyphenyl)ethoxy]-1-{5-[4-(methylsulfanyl)phenyl]pentyl}-1H-indol-3-yl}ethan-1-amine |
| Formula | C31H38N2O2S |
| Mass | 502.711 |
| Exact Mass | 502.2653992 |
| Composition | C (74.06%), H (7.62%), N (5.57%), O (6.37%), S (6.38%) |
| Atom Count | 74 |
| PI | No isoelectric point. |
| Smiles | c1c(ccc2c1c(cn2CCCCCc1ccc(cc1)SC)CCN)OCCc1ccc(cc1)OC |
| InChI | 1S/C31H38N2O2S/c1-34-27-11-7-25(8-12-27)18-21-35-28-13-16-31-30(22-28)26(17-19-32)23-33(31)20-5-3-4-
6-24-9-14-29(36-2)15-10-24/h7-16,22-23H,3-6,17-21,32H2,1-2H3 |
| InChIKey | GWILIXWGRREEOE-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 | 20456957 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR3 | VEGFR2 | IGF1R | ALL |
| Pub Chem Link |
46888668
|
| Drug Bank Link | - |
| ChemSpider Link | 25050190 |
| ChEMBL Link | CHEMBL1199063 |
