| General Property |
| Molceule ID (DB) | EGIN0002529 |
| Inhibitor Class | Iso-quinoline |
| Molecule Name in Refrence Article | 15 compound |
| IUPAC Name | N-{1-[(3-bromophenyl)amino]-4-cyanoisoquinolin-7-yl}furan-2-carboxamide |
| Formula | C21H13BrN4O2 |
| Mass | 433.258 |
| Exact Mass | 432.0221883 |
| Composition | C (58.22%), H (3.02%), Br (18.44%), N (12.93%), O (7.39%) |
| Atom Count | 41 |
| PI | 5.65 |
| Smiles | c1(ccc2c(c1)c(ncc2C#N)Nc1cc(ccc1)Br)NC(=O)c1ccco1 |
| InChI | 1S/C21H13BrN4O2/c22-14-3-1-4-15(9-14)25-20-18-10-16(26-21(27)19-5-2-8-28-19)6-7-17(18)13(11-23)12-24
-20/h1-10,12H,(H,24,25)(H,26,27) |
| InChIKey | GRAWSTNUDRSLLQ-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 | 21130659 |
| 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 |
53319131
|
| Drug Bank Link | - |
| ChemSpider Link | 26375544 |
| ChEMBL Link | CHEMBL1641996 |
