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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Vasopressin V1a receptor | ||
| Ligand | BDBM50546418 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2015642 (CHEMBL4669220) | ||
| Ki | 570±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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| BDBM50546418 | |||
| n/a | |||
| Name | BDBM50546418 | ||
| Synonyms: | CHEMBL4745630 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C21H21ClN4O | ||
| Mol. Mass. | 380.871 | ||
| SMILES | [H][C@]12C[C@@]1([H])c1cc(Cl)ccc1-n1c(nnc21)[C@H]1CC[C@@H](CC1)c1cc(C)on1 |r,wU:17.20,wD:20.27,3.4,1.0,(66.07,-56.69,;65.31,-55.37,;64.29,-56.52,;63.81,-55.06,;62.71,-56.13,;63.33,-53.59,;61.84,-53.29,;61.34,-51.84,;59.83,-51.53,;62.36,-50.69,;63.87,-50.99,;64.35,-52.44,;65.85,-52.75,;67.1,-51.85,;68.35,-52.75,;67.88,-54.22,;66.34,-54.22,;67.1,-50.32,;65.77,-49.54,;65.78,-48,;67.12,-47.24,;68.45,-48.01,;68.44,-49.55,;67.12,-45.69,;65.88,-44.78,;66.37,-43.32,;65.46,-42.06,;67.91,-43.32,;68.37,-44.79,)| | ||
| Structure | 
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