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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Kappa-type opioid receptor | ||
| Ligand | BDBM50271817 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_556764 (CHEMBL961462) | ||
| IC50 | 5061±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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| BDBM50271817 | |||
| n/a | |||
| Name | BDBM50271817 | ||
| Synonyms: | (3S,6S)-6-Cyclohexyl-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. | C20H36N3 | ||
| Mol. Mass. | 318.5194 | ||
| SMILES | C[C@H]1C[NH+]=C2N(CC3CCC(C)CC3)[C@H](CN12)C1CCCCC1 |r,wD:14.19,1.0,t:3,(26.73,-19.75,;27.16,-21.22,;26.23,-22.46,;27.08,-23.72,;28.57,-23.29,;30.02,-23.8,;30.46,-25.27,;29.4,-26.39,;27.91,-26.03,;26.85,-27.14,;27.29,-28.62,;26.23,-29.73,;28.79,-28.98,;29.86,-27.86,;30.96,-22.57,;30.09,-21.31,;28.62,-21.74,;32.5,-22.61,;33.23,-23.96,;34.76,-24,;35.57,-22.69,;34.84,-21.33,;33.29,-21.29,)| | ||
| Structure | 
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