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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Kappa-type opioid receptor | ||
| Ligand | BDBM50271310 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_556764 (CHEMBL961462) | ||
| IC50 | 1568±n/a nM | ||
| Citation |  Martínez-Mayorga, K; Medina-Franco, JL; Giulianotti, MA; Pinilla, C; Dooley, CT; Appel, JR; Houghten, RA Conformation-opioid activity relationships of bicyclic guanidines from 3D similarity analysis. Bioorg Med Chem16:5932-8 (2008) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Kappa-type opioid receptor | |||
| Name: | Kappa-type opioid receptor | ||
| Synonyms: | Kappa Opioid Receptor | OPIATE Kappa | OPRK1 | OPRK_CAVPO | Opiate Kappa 1 | mu/kappa opioid receptor | ||
| Type: | G Protein-Coupled Receptor (GPCR) | ||
| Mol. Mass.: | 42744.99 | ||
| Organism: | Cavia porcellus (domestic guinea pig) | ||
| Description: | P41144 | ||
| Residue: | 380 | ||
| Sequence: |
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| BDBM50271310 | |||
| n/a | |||
| Name | BDBM50271310 | ||
| Synonyms: | (3S,6S)-6-(4-Methoxy-benzyl)-3-methyl-7-(4-methyl-cyclohexylmethyl)-2,5,6,7-tetrahydro-3H-imidazo[1,2-a]imidazol-1-ium | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H34N3O | ||
| Mol. Mass. | 356.5243 | ||
| SMILES | COc1ccc(C[C@H]2CN3[C@@H](C)C[NH+]=C3N2CC2CCC(C)CC2)cc1 |r,wD:10.10,7.6,c:13,(2.37,2.47,;.83,2.51,;.03,1.19,;.77,-.16,;-.03,-1.47,;-1.57,-1.43,;-2.37,-2.74,;-3.91,-2.7,;-4.79,-1.43,;-6.26,-1.87,;-7.72,-1.34,;-8.16,.12,;-8.66,-2.58,;-7.79,-3.85,;-6.31,-3.42,;-4.85,-3.93,;-4.41,-5.41,;-5.47,-6.52,;-6.97,-6.17,;-8.02,-7.28,;-7.59,-8.76,;-8.65,-9.87,;-6.09,-9.12,;-5.03,-8,;-2.31,-.09,;-1.51,1.23,)| | ||
| Structure | 
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