General Property |
Molceule ID (DB) | EGIN0000479 |
Inhibitor Class | Phenyl-urea |
Molecule Name in Refrence Article | 12a compound |
IUPAC Name | 3-[(2-hydroxy-3,5-dimethylphenyl)methyl]-3-[(4-hydroxyphenyl)methyl]-1-phenylurea |
Formula | C23H24N2O3 |
Mass | 376.4483 |
Exact Mass | 376.1786926 |
Composition | C (73.38%), H (6.43%), N (7.44%), O (12.75%) |
Atom Count | 52 |
PI | 2.93 |
Smiles | c1(cc(cc(c1O)C)C)CN(C(=O)Nc1ccccc1)Cc1ccc(cc1)O |
InChI | 1S/C23H24N2O3/c1-16-12-17(2)22(27)19(13-16)15-25(14-18-8-10-21(26)11-9-18)23(28)24-20-6-4-3-5-7-20/h
3-13,26-27H,14-15H2,1-2H3,(H,24,28) |
InChIKey | NBVZPICHNRCCJN-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000479.png) | Structure Backbone | ![](./frame/f_EGIN0000479.png) |
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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 | 24643166 |
ChEMBL Link | CHEMBL589068 |