| General Property |
| Molceule ID (DB) | EGIN0000862 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 25 compound |
| IUPAC Name | 4-[(3-chloro-4-hydroxyphenyl)amino]-6,7-dimethoxyquinoline-3-carbonitrile |
| Formula | C18H14ClN3O3 |
| Mass | 355.775 |
| Exact Mass | 355.072369 |
| Composition | C (60.77%), H (3.97%), Cl (9.97%), N (11.81%), O (13.49%) |
| Atom Count | 39 |
| PI | 6.46 |
| Smiles | c12c(cc(c(c1)OC)OC)ncc(c2Nc1ccc(c(c1)Cl)O)C#N |
| InChI | 1S/C18H14ClN3O3/c1-24-16-6-12-14(7-17(16)25-2)21-9-10(8-20)18(12)22-11-3-4-15(23)13(19)5-11/h3-7,9,2
3H,1-2H3,(H,21,22) |
| InChIKey | DUDXBCAIXIMAKI-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 | 10966743 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
5328857
|
| Drug Bank Link | - |
| ChemSpider Link | 4486019 |
| ChEMBL Link | CHEMBL110945 |
