| General Property |
| Molceule ID (DB) | EGIN0000503 |
| Inhibitor Class | Thiourea |
| Molecule Name in Refrence Article | 18b compound |
| IUPAC Name | 3-butyl-3-[(2-hydroxy-3,5-dimethylphenyl)methyl]-1-phenylthiourea |
| Formula | C20H26N2OS |
| Mass | 342.498 |
| Exact Mass | 342.1765842 |
| Composition | C (70.14%), H (7.65%), N (8.18%), O (4.67%), S (9.36%) |
| Atom Count | 50 |
| PI | 3.09 |
| Smiles | c1(cc(cc(c1O)C)C)CN(C(=S)Nc1ccccc1)CCCC |
| InChI | 1S/C20H26N2OS/c1-4-5-11-22(20(24)21-18-9-7-6-8-10-18)14-17-13-15(2)12-16(3)19(17)23/h6-10,12-13,23H,
4-5,11,14H2,1-3H3,(H,21,24) |
| InChIKey | BWGYANQHRGIWMS-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 | 19914837 |
| 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 | - |
| ChEMBL Link | CHEMBL589365 |
