| General Property |
| Molceule ID (DB) | EGIN0000484 |
| Inhibitor Class | Phenyl-urea |
| Molecule Name in Refrence Article | 17a compound |
| IUPAC Name | 3-butyl-3-[(3,5-dibromo-2-hydroxyphenyl)methyl]-1-phenylurea |
| Formula | C18H20Br2N2O2 |
| Mass | 456.172 |
| Exact Mass | 453.9891532 |
| Composition | C (47.39%), H (4.42%), Br (35.03%), N (6.14%), O (7.01%) |
| Atom Count | 44 |
| PI | 2.29 |
| Smiles | c1(cc(cc(c1O)Br)Br)CN(C(=O)Nc1ccccc1)CCCC |
| InChI | 1S/C18H20Br2N2O2/c1-2-3-9-22(18(24)21-15-7-5-4-6-8-15)12-13-10-14(19)11-16(20)17(13)23/h4-8,10-11,23
H,2-3,9,12H2,1H3,(H,21,24) |
| InChIKey | BKAKEQNATCRPPB-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 | 24645686 |
| ChEMBL Link | CHEMBL590759 |
