| General Property |
| Molceule ID (DB) | EGIN0000428 |
| Inhibitor Class | Cinnamic acid metronidazole ester |
| Molecule Name in Refrence Article | 3p compound |
| IUPAC Name | 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (2E)-3-(3-fluorophenyl)prop-2-enoate |
| Formula | C15H14FN3O4 |
| Mass | 319.2878 |
| Exact Mass | 319.0968342 |
| Composition | C (56.43%), H (4.42%), F (5.95%), N (13.16%), O (20.04%) |
| Atom Count | 37 |
| PI | 11.65 |
| Smiles | c1c(cccc1/C=C/C(=O)OCCn1c(ncc1N(=O)=O)C)F |
| InChI | 1S/C15H14FN3O4/c1-11-17-10-14(19(21)22)18(11)7-8-23-15(20)6-5-12-3-2-4-13(16)9-12/h2-6,9-10H,7-8H2,1
H3/b6-5+ |
| InChIKey | CYFPQVFLFVUCKY-AATRIKPKSA-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 | 25038648 |
| ChEMBL Link | CHEMBL1172951 |
