| General Property |
| Molceule ID (DB) | EGIN0001930 |
| Inhibitor Class | Quinoline |
| Molecule Name in Refrence Article | 33 compound |
| IUPAC Name | 6-[4-(aminomethyl)phenyl]-4-{[(1R,2S)-2-phenylcyclopropyl]amino}quinoline-3-carbonitrile |
| Formula | C26H22N4 |
| Mass | 390.4797 |
| Exact Mass | 390.1844467 |
| Composition | C (79.97%), H (5.68%), N (14.35%) |
| Atom Count | 52 |
| PI | No isoelectric point. |
| Smiles | c1(ccc2c(c1)c(c(cn2)C#N)N[C@@H]1C[C@H]1c1ccccc1)c1ccc(cc1)CN |
| InChI | 1S/C26H22N4/c27-14-17-6-8-18(9-7-17)20-10-11-24-23(12-20)26(21(15-28)16-29-24)30-25-13-22(25)19-4-2-
1-3-5-19/h1-12,16,22,25H,13-14,27H2,(H,29,30)/t22-,25+/m0/s1 |
| InChIKey | XZLGYNGUWUQCLQ-WIOPSUGQSA-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 | SRC | SYK | ABL | Flt-1 | KDR | ALL |
| Pub Chem Link |
44442742
|
| Drug Bank Link | - |
| ChemSpider Link | 23307340 |
| ChEMBL Link | CHEMBL245800 |
