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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bifunctional epoxide hydrolase 2 | ||
| Ligand | BDBM50436434 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1752865 (CHEMBL4187625) | ||
| IC50 | 2.0±n/a nM | ||
| Citation |  Kodani, SD; Bhakta, S; Hwang, SH; Pakhomova, S; Newcomer, ME; Morisseau, C; Hammock, BD Identification and optimization of soluble epoxide hydrolase inhibitors with dual potency towards fatty acid amide hydrolase. Bioorg Med Chem Lett28:762-768 (2018) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bifunctional epoxide hydrolase 2 | |||
| Name: | Bifunctional epoxide hydrolase 2 | ||
| Synonyms: | Cytosolic epoxide hydrolase 2 | EBifunctional epoxide hydrolase 2 | EPHX2 | Epoxide hydratase | HYES_HUMAN | Lipid-phosphate phosphatase | Soluble epoxide hydrolase (sEH) | epoxide hydrolase 2, cytoplasmic | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 62613.07 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P34913 | ||
| Residue: | 555 | ||
| Sequence: |
| ||
| BDBM50436434 | |||
| n/a | |||
| Name | BDBM50436434 | ||
| Synonyms: | CHEMBL2397138 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H24F3N3O4 | ||
| Mol. Mass. | 451.4389 | ||
| SMILES | CNC(=O)c1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:9.8,wD:12.15,(42.37,-47.49,;41.03,-46.72,;41.04,-45.18,;42.37,-44.41,;39.7,-44.41,;38.36,-45.17,;37.03,-44.4,;37.04,-42.86,;35.71,-42.08,;34.37,-42.85,;34.37,-44.39,;33.04,-45.15,;31.71,-44.39,;31.71,-42.85,;33.04,-42.07,;30.38,-45.16,;29.04,-44.39,;29.04,-42.85,;27.71,-45.16,;26.38,-44.4,;26.38,-42.85,;25.05,-42.09,;23.71,-42.86,;22.38,-42.09,;22.37,-40.55,;21.04,-39.79,;23.7,-39.78,;22.36,-39.01,;23.72,-44.41,;25.05,-45.17,;38.37,-42.09,;39.7,-42.86,)| | ||
| Structure | 
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