| General Property |
| Molceule ID (DB) | EGIN0000420 |
| Inhibitor Class | Cinnamic acid metronidazole ester |
| Molecule Name in Refrence Article | 3h compound |
| IUPAC Name | 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (2E)-3-(4-phenylphenyl)prop-2-enoate |
| Formula | C21H19N3O4 |
| Mass | 377.3933 |
| Exact Mass | 377.1375561 |
| Composition | C (66.83%), H (5.07%), N (11.13%), O (16.96%) |
| Atom Count | 47 |
| PI | 11.77 |
| Smiles | c1cc(ccc1/C=C/C(=O)OCCn1c(ncc1N(=O)=O)C)c1ccccc1 |
| InChI | 1S/C21H19N3O4/c1-16-22-15-20(24(26)27)23(16)13-14-28-21(25)12-9-17-7-10-19(11-8-17)18-5-3-2-4-6-18/h
2-12,15H,13-14H2,1H3/b12-9+ |
| InChIKey | AFISYERGFLOUQT-FMIVXFBMSA-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 | 20594859 |
| 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 | 25047584 |
| ChEMBL Link | CHEMBL1173718 |
