| General Property |
| Molceule ID (DB) | EGIN0004335 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 3a compound |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinolin-6-yl}prop-2-enamide |
| Formula | C18H14BrN3O |
| Mass | 368.227 |
| Exact Mass | 367.0320247 |
| Composition | C (58.71%), H (3.83%), Br (21.7%), N (11.41%), O (4.34%) |
| Atom Count | 37 |
| PI | 10.95 |
| Smiles | c1(ccc2c(c1)c(ccn2)Nc1cc(ccc1)Br)NC(=O)C=C |
| InChI | 1S/C18H14BrN3O/c1-2-18(23)22-14-6-7-16-15(11-14)17(8-9-20-16)21-13-5-3-4-12(19)10-13/h2-11H,1H2,(H,2
0,21)(H,22,23) |
| InChIKey | LOJBBIAOHTVLEF-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 | 20222733 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 24676510 |
| ChEMBL Link | CHEMBL1090840 |
