| General Property |
| Molceule ID (DB) | EGIN0004396 |
| Inhibitor Class | Pyrazolyl-thiazolinone |
| Molecule Name in Refrence Article | E25 |
| IUPAC Name | 2-[(5S)-3-(4-methylphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4,5-dihydro-1,3-thiazol-4-one |
| Formula | C19H17N3OS |
| Mass | 335.423 |
| Exact Mass | 335.1092329 |
| Composition | C (68.03%), H (5.11%), N (12.53%), O (4.77%), S (9.56%) |
| Atom Count | 41 |
| PI | 7.82 |
| Smiles | c1c(ccc(c1)C1=NN([C@@H](C1)c1ccccc1)C1=NC(=O)CS1)C |
| InChI | 1S/C19H17N3OS/c1-13-7-9-14(10-8-13)16-11-17(15-5-3-2-4-6-15)22(21-16)19-20-18(23)12-24-19/h2-10,17H,
11-12H2,1H3/t17-/m0/s1 |
| InChIKey | OQVSAKUFJLVWSE-KRWDZBQOSA-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 | 22361272 |
| 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 | 28494020 |
| ChEMBL Link | - |
