| General Property |
| Molceule ID (DB) | EGIN0001920 |
| Inhibitor Class | Quinoline |
| Molecule Name in Refrence Article | 23 compound |
| IUPAC Name | 6-(benzyloxy)-7-methoxy-4-{[(1R,2S)-2-phenylcyclopropyl]amino}quinoline-3-carbonitrile |
| Formula | C27H23N3O2 |
| Mass | 421.4904 |
| Exact Mass | 421.179027 |
| Composition | C (76.94%), H (5.5%), N (9.97%), O (7.59%) |
| Atom Count | 55 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc2c(c1)c(c(cn2)C#N)N[C@@H]1C[C@H]1c1ccccc1)OC)OCc1ccccc1 |
| InChI | 1S/C27H23N3O2/c1-31-25-14-23-22(13-26(25)32-17-18-8-4-2-5-9-18)27(20(15-28)16-29-23)30-24-12-21(24)1
9-10-6-3-7-11-19/h2-11,13-14,16,21,24H,12,17H2,1H3,(H,29,30)/t21-,24+/m0/s1 |
| InChIKey | VUQMYHHPJSYQNN-XUZZJYLKSA-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 | 17827009 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | ABL | SYK | Flt-1 | SRC | KDR | ALL |
| Pub Chem Link |
44442732
|
| Drug Bank Link | - |
| ChemSpider Link | 23307329 |
| ChEMBL Link | CHEMBL248220 |
