| General Property |
| Molceule ID (DB) | EGIN0000500 |
| Inhibitor Class | Thiourea |
| Molecule Name in Refrence Article | 15b compound |
| IUPAC Name | 3-butyl-3-[(2-hydroxy-3-methylphenyl)methyl]-1-phenylthiourea |
| Formula | C19H24N2OS |
| Mass | 328.472 |
| Exact Mass | 328.1609341 |
| Composition | C (69.47%), H (7.36%), N (8.53%), O (4.87%), S (9.76%) |
| Atom Count | 47 |
| PI | 3.04 |
| Smiles | c1(cccc(c1O)C)CN(C(=S)Nc1ccccc1)CCCC |
| InChI | 1S/C19H24N2OS/c1-3-4-13-21(14-16-10-8-9-15(2)18(16)22)19(23)20-17-11-6-5-7-12-17/h5-12,22H,3-4,13-14
H2,1-2H3,(H,20,23) |
| InChIKey | MSQALUIPMRXAFL-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 | 24644123 |
| ChEMBL Link | CHEMBL591437 |
