| General Property |
| Molceule ID (DB) | EGIN0000921 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 32 compound |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]pyrido[3,4-d]pyrimidin-6-yl}ethene-1-sulfonamide |
| Formula | C15H12BrN5O2S |
| Mass | 406.257 |
| Exact Mass | 404.989508 |
| Composition | C (44.35%), H (2.98%), Br (19.67%), N (17.24%), O (7.88%), S (7.89%) |
| Atom Count | 36 |
| PI | 6.32 |
| Smiles | n1cnc2c(c1Nc1cccc(c1)Br)cc(nc2)NS(=O)(=O)C=C |
| InChI | 1S/C15H12BrN5O2S/c1-2-24(22,23)21-14-7-12-13(8-17-14)18-9-19-15(12)20-11-5-3-4-10(16)6-11/h2-9H,1H2,
(H,17,21)(H,18,19,20) |
| InChIKey | DECUBVXBHCLQNY-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 | 11462982 |
| 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 |
5329093
|
| Drug Bank Link | - |
| ChemSpider Link | 4486255 |
| ChEMBL Link | CHEMBL139095 |
