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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Vasopressin V1a receptor | ||
| Ligand | BDBM50546437 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2015644 (CHEMBL4669222) | ||
| IC50 | 1.3±n/a nM | ||
| Citation |  Bozó, É; Baska, F; Lövei, K; Szántó, G; Domány-Kovács, K; Kurkó, D; Szondiné Kordás, K; Szokoli, T; Bata, I New V1a receptor antagonist. Part 2. Identification and optimization of triazolobenzazepines. Bioorg Med Chem Lett30:0 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Vasopressin V1a receptor | |||
| Name: | Vasopressin V1a receptor | ||
| Synonyms: | AVPR V1a | AVPR1 | AVPR1A | Antidiuretic hormone receptor 1a | V1AR_HUMAN | V1aR | VASOPRESSIN V1A | Vascular/hepatic-type arginine vasopressin receptor | Vasopressin V1 receptor | Vasopressin V1a receptor | Vasopressin receptor | ||
| Type: | Receptor | ||
| Mol. Mass.: | 46820.18 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P37288 | ||
| Residue: | 418 | ||
| Sequence: |
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| BDBM50546437 | |||
| n/a | |||
| Name | BDBM50546437 | ||
| Synonyms: | CHEMBL4799412 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H23BrN4O | ||
| Mol. Mass. | 439.348 | ||
| SMILES | Brc1ccc-2c(CCCc3nnc([C@H]4CC[C@@H](CC4)Oc4ccccn4)n-23)c1 |r,wU:13.12,wD:16.19,(39.85,-28.42,;41.2,-29.15,;42.52,-28.33,;43.87,-29.07,;43.91,-30.61,;42.6,-31.41,;42.41,-32.94,;43.49,-34.04,;45.02,-33.88,;45.85,-32.58,;47.38,-32.59,;47.85,-31.13,;46.61,-30.22,;46.6,-28.68,;45.27,-27.9,;45.28,-26.36,;46.62,-25.59,;47.95,-26.37,;47.95,-27.92,;46.63,-24.06,;45.3,-23.28,;45.32,-21.75,;43.99,-20.97,;42.66,-21.74,;42.66,-23.28,;43.98,-24.05,;45.36,-31.13,;41.25,-30.68,)| | ||
| Structure | 
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