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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Monoglyceride lipase | ||
| Ligand | BDBM581594 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Biological Assay | ||
| IC50 | 0.094±n/a nM | ||
| Citation |  Alcazar, J; Ameriks, MK; Berry, CB; Garcia-Reynaga, P; Samant, AV; Vega-Ramiro, JA Azaspirocycles as monoacylglycerol lipase modulators US Patent US11505546 Publication Date 11/22/2022 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Monoglyceride lipase | |||
| Name: | Monoglyceride lipase | ||
| Synonyms: | HU-K5 | Lysophospholipase homolog | Lysophospholipase-like | MAGL | MGL | MGLL | MGLL_HUMAN | ||
| Type: | Hydrolase | ||
| Mol. Mass.: | 33264.56 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Human recombinant MGL (Cayman Chemical, cat# 10008354). | ||
| Residue: | 303 | ||
| Sequence: |
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| BDBM581594 | |||
| n/a | |||
| Name | BDBM581594 | ||
| Synonyms: | (2s,4s)-2-[2-[3-(Trifluoromethoxy)phenyl]-7-azaspiro[3.5]nonane-7-carbonyl)-7- oxa-5-azaspiro[3.4]octan-6-one | US11505546, Example 9 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H25F3N2O4 | ||
| Mol. Mass. | 438.4401 | ||
| SMILES | FC(F)(F)Oc1cccc(c1)C1CC2(C1)CCN(CC2)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2 |r,wU:22.24,wD:24.27,(8.53,2.18,;8.53,.64,;10.07,.64,;6.99,.64,;8.53,-.9,;7.2,-1.67,;7.15,-3.24,;5.82,-4.01,;4.48,-3.24,;4.48,-1.7,;5.82,-.93,;3.15,-.93,;1.66,-1.33,;1.26,.16,;2.75,.56,;-.07,-.61,;-1.41,.16,;-1.41,1.7,;-.07,2.47,;1.26,1.7,;-2.74,2.47,;-2.74,4.01,;-4.07,1.7,;-4.47,.21,;-5.96,.61,;-5.56,2.1,;-5.96,-.93,;-7.42,-1.41,;-8.33,-.16,;-9.82,.24,;-7.42,1.09,)| | ||
| Structure | 
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