| General Property |
| Molceule ID (DB) | EGIN0000626 |
| Inhibitor Class | Benzamidine |
| Molecule Name in Refrence Article | 2d compound |
| IUPAC Name | 2-amino-N-(3-chloro-4-fluorophenyl)-4,5-dimethoxybenzene-1-carboximidamide |
| Formula | C15H15ClFN3O2 |
| Mass | 323.75 |
| Exact Mass | 323.0836827 |
| Composition | C (55.65%), H (4.67%), Cl (10.95%), F (5.87%), N (12.98%), O (9.88%) |
| Atom Count | 37 |
| PI | No isoelectric point. |
| Smiles | c1(c(cc(c(c1)OC)OC)N)C(=N)Nc1ccc(c(c1)Cl)F |
| InChI | 1S/C15H15ClFN3O2/c1-21-13-6-9(12(18)7-14(13)22-2)15(19)20-8-3-4-11(17)10(16)5-8/h3-7H,18H2,1-2H3,(H2
,19,20) |
| InChIKey | RUBGKCLYYQGAIS-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 | 15186837 |
| 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 |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 23166058 |
| ChEMBL Link | CHEMBL308531 |
