| General Property |
| Molceule ID (DB) | EGIN0003222 |
| Inhibitor Class | Pyrimidinyl-imidazole |
| Molecule Name in Refrence Article | SB203580 |
| IUPAC Name | 4-[4-(4-fluorophenyl)-2-[(S)-methanesulfinyl]-1H-imidazol-5-yl]pyridine |
| Formula | C15H12FN3OS |
| Mass | 301.339 |
| Exact Mass | 301.0685109 |
| Composition | C (59.79%), H (4.01%), F (6.3%), N (13.94%), O (5.31%), S (10.64%) |
| Atom Count | 33 |
| PI | 7.34 |
| Smiles | [nH]1c(c(nc1[S@@](=O)C)c1ccc(cc1)F)c1ccncc1 |
| InChI | 1S/C15H12FN3OS/c1-21(20)15-18-13(10-2-4-12(16)5-3-10)14(19-15)11-6-8-17-9-7-11/h2-9H,1H3,(H,18,19)/t
21-/m0/s1 |
| InChIKey | LOOXYPDMCKAHLK-NRFANRHFSA-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 | 11597418 | 15711537 | |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | cdc2 | c-Raf | EGFR | ERK2 | JNK1 | JNK2b2 | P38a | p56 | PKC alpha | PKC beta 2 | ALL |
| Pub Chem Link |
9926384
|
| Drug Bank Link | - |
| ChemSpider Link | 8102018 |
| ChEMBL Link | - |
