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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Kappa-type opioid receptor | ||
| Ligand | BDBM50272035 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_145797 (CHEMBL756064) | ||
| IC50 | 2969±n/a nM | ||
| Citation |  Houghten, RA; Pinilla, C; Appel, JR; Blondelle, SE; Dooley, CT; Eichler, J; Nefzi, A; Ostresh, JM Mixture-based synthetic combinatorial libraries. J Med Chem42:3743-78 (1999) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Kappa-type opioid receptor | |||
| Name: | Kappa-type opioid receptor | ||
| Synonyms: | K-OR-1 | KOR-1 | Kappa-opioid receptor (KOR) | Kappa-type opioid receptor (KOPR) | Kappa-type opioid receptor (KOR) | Kappa-type opioid receptor (Kappa) | OPIATE Kappa | OPRK | OPRK1 | OPRK_HUMAN | kappa opioid receptor (KOR) | ||
| Type: | G Protein-Coupled Receptor (GPCR) | ||
| Mol. Mass.: | 42648.76 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P41145 | ||
| Residue: | 380 | ||
| Sequence: |
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| BDBM50272035 | |||
| n/a | |||
| Name | BDBM50272035 | ||
| Synonyms: | (2S,5R)-5-cyclohexyl-2-[(4-methoxyphenyl)methyl]-1-[(4-methylcyclohexyl)methyl]-1H,2H,3H,5H,6H-imidazo[1,2-a]imidazolidin-7-ium | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H42N3O | ||
| Mol. Mass. | 424.6413 | ||
| SMILES | COc1ccc(CC2C[N+]3=C(NCC3C3CCCCC3)N2CC2CCC(C)CC2)cc1 |t:9,(20.14,3.61,;18.6,3.65,;17.79,2.33,;18.53,.98,;17.73,-.34,;16.19,-.29,;15.39,-1.6,;13.85,-1.57,;12.97,-.3,;11.5,-.73,;11.45,-2.28,;9.98,-2.71,;9.1,-1.45,;10.04,-.21,;9.61,1.26,;10.66,2.37,;10.23,3.85,;8.73,4.21,;7.67,3.09,;8.1,1.61,;12.91,-2.79,;13.35,-4.27,;12.29,-5.39,;10.8,-5.03,;9.74,-6.14,;10.17,-7.62,;9.11,-8.74,;11.67,-7.98,;12.74,-6.87,;15.45,1.05,;16.25,2.36,)| | ||
| Structure | 
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