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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bifunctional epoxide hydrolase 2 | ||
| Ligand | BDBM50454624 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1752865 (CHEMBL4187625) | ||
| IC50 | 3.0±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: |
| ||
| BDBM50454624 | |||
| n/a | |||
| Name | BDBM50454624 | ||
| Synonyms: | CHEMBL4209593 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H26F3N3O6 | ||
| Mol. Mass. | 509.4749 | ||
| SMILES | COC(=O)CNC(=O)c1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:13.12,wD:16.19,(29.69,-8.45,;28.35,-9.22,;27.02,-8.45,;27.02,-6.91,;25.68,-9.22,;24.35,-8.45,;23.02,-9.22,;23.02,-10.76,;21.68,-8.45,;20.35,-9.21,;19.02,-8.44,;19.03,-6.9,;17.69,-6.13,;16.36,-6.9,;16.35,-8.44,;15.02,-9.2,;13.7,-8.43,;13.68,-6.89,;15.02,-6.12,;12.36,-9.2,;11.03,-8.43,;11.03,-6.89,;9.7,-9.2,;8.36,-8.43,;7.02,-9.21,;5.69,-8.44,;5.69,-6.89,;4.36,-6.12,;4.36,-4.58,;4.36,-3.18,;5.6,-3.56,;3.11,-3.56,;7.02,-6.12,;8.36,-6.88,;20.35,-6.13,;21.68,-6.9,)| | ||
| Structure | 
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