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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Vasopressin V1a receptor | ||
| Ligand | BDBM50546438 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2015642 (CHEMBL4669220) | ||
| Ki | 2.3±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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| BDBM50546438 | |||
| n/a | |||
| Name | BDBM50546438 | ||
| Synonyms: | CHEMBL4741178 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H24N4O | ||
| Mol. Mass. | 360.4522 | ||
| SMILES | C1C[C@@H](CC[C@H]1Oc1ccccn1)c1nnc2CCCc3ccccc3-n12 |r,wU:2.14,wD:5.6,(62.24,-26.43,;62.23,-27.97,;63.56,-28.75,;64.91,-27.99,;64.91,-26.44,;63.58,-25.66,;63.59,-24.13,;62.26,-23.35,;62.28,-21.82,;60.95,-21.04,;59.62,-21.8,;59.62,-23.35,;60.94,-24.12,;63.57,-30.29,;64.81,-31.19,;64.33,-32.65,;62.81,-32.65,;61.97,-33.95,;60.45,-34.11,;59.37,-33.01,;59.56,-31.48,;58.21,-30.75,;58.16,-29.21,;59.48,-28.4,;60.83,-29.14,;60.87,-30.68,;62.32,-31.19,)| | ||
| Structure | 
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