| General Property |
| Molceule ID (DB) | EGIN0002998 |
| Inhibitor Class | Indole |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 4-(2-{[3-(2-aminoethyl)-1-{5-[4-(methylsulfanyl)phenyl]pentyl}-1H-indol-5-yl]oxy}ethyl)phenol |
| Formula | C30H36N2O2S |
| Mass | 488.684 |
| Exact Mass | 488.2497491 |
| Composition | C (73.73%), H (7.43%), N (5.73%), O (6.55%), S (6.56%) |
| Atom Count | 71 |
| PI | 9.91 |
| Smiles | CSc1ccc(CCCCCn2cc(CCN)c3cc(OCCc4ccc(O)cc4)ccc23)cc1 |
| InChI | 1S/C30H36N2O2S/c1-35-28-13-8-23(9-14-28)5-3-2-4-19-32-22-25(16-18-31)29-21-27(12-15-30(29)32)34-20-1
7-24-6-10-26(33)11-7-24/h6-15,21-22,33H,2-5,16-20,31H2,1H3 |
| InChIKey | KTYVAFOTAYILKZ-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 | VEGFR2 | IGF1R | VEGFR3 | ALL |
| Pub Chem Link |
46888635
|
| Drug Bank Link | - |
| ChemSpider Link | 25050380 |
| ChEMBL Link | CHEMBL1199043 |
