| General Property |
| Molceule ID (DB) | EGIN0003428 |
| Inhibitor Class | Benzamide |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | N-cyclopropyl-2,4-difluoro-5-[({2-[(pyridin-2-yl)amino]-1,3-thiazol-5-yl}methyl)amino]benzamide |
| Formula | C19H17F2N5OS |
| Mass | 401.433 |
| Exact Mass | 401.1121873 |
| Composition | C (56.85%), H (4.27%), F (9.47%), N (17.45%), O (3.99%), S (7.99%) |
| Atom Count | 45 |
| PI | 7.42 |
| Smiles | c1(c(cc(c(c1)F)C(=O)NC1CC1)NCc1sc(nc1)Nc1ncccc1)F |
| InChI | 1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22
-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26) |
| InChIKey | CUPLTRAPYIXFAX-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 | 16789733 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | AKT | CaMKII | CDK2 | c-kit | FGFR1 | Flk-1 | GSK-3 | IGF1R | IKK | Itk | JAK3 | Lck | MAPKAPK2 | MEK | p38 | PDGFR beta | PKC alpha | PKC beta | PKC tau | PKC zeta | Src | SRPK1 | Syk | VEGFR1 | VEGFR2 | ALL |
| Pub Chem Link |
11632737
|
| Drug Bank Link | - |
| ChemSpider Link | 9807482 |
| ChEMBL Link | CHEMBL377734 |
