| General Property |
| Molceule ID (DB) | EGIN0004390 |
| Inhibitor Class | Pyrazolyl-thiazolinone |
| Molecule Name in Refrence Article | E30 |
| IUPAC Name | 2-[(5S)-5-(4-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4,5-dihydro-1,3-thiazol-4-one |
| Formula | C20H19N3O2S |
| Mass | 365.449 |
| Exact Mass | 365.1197976 |
| Composition | C (65.73%), H (5.24%), N (11.5%), O (8.76%), S (8.77%) |
| Atom Count | 45 |
| PI | 7.75 |
| Smiles | c1c(ccc(c1)C1=NN([C@@H](C1)c1ccc(cc1)OC)C1=NC(=O)CS1)C |
| InChI | 1S/C20H19N3O2S/c1-13-3-5-14(6-4-13)17-11-18(15-7-9-16(25-2)10-8-15)23(22-17)20-21-19(24)12-26-20/h3-
10,18H,11-12H2,1-2H3/t18-/m0/s1 |
| InChIKey | IOFSQNYFJYCKST-SFHVURJKSA-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 | 28497573 |
| ChEMBL Link | - |
