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Almorexant HCl是一种活性双重食欲素受体拮抗剂，对OX1和OX2受体3的IC50为6.6 nM和3.4 nM。
靶点信息
| OX2 receptor | OX1 receptor | |||
| 3.4 nM | 6.6 nM |
| In vitro (25°C) | DMSO | 62 mg/mL (112.93 mM) | |
| Water | Insoluble | ||
| Ethanol | 44 mg/mL (80.14 mM) | ||
| In vivo | 2% DMSO+25% ??-cyclodextrin in saline | 8 mg/mL | |
|
* <1 mg/ml means slightly soluble or insoluble. * Please note that Adooq tests the solubility of all compounds in-house, and the actual solubility may differ slightly from published values. This is normal and is due to slight batch-to-batch variations. |
|||
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 0.1 mM | 18.21 mL | 91.07 mL | 182.14 mL |
| 0.5 mM | 3.64 mL | 18.21 mL | 36.43 mL |
| 1 mM | 1.82 mL | 9.11 mL | 18.21 mL |
| 5 mM | 0.36 mL | 1.82 mL | 3.64 mL |
*The above data is based on the productmolecular weight 549.02. Batch specific molecular weights may vary from batch to batch due to solvent of hydration, which will affect the solvent volumes required to prepare stock solutions.
| 目录号 | A14286 |
|---|---|
| 作用机制 | Antagonist (拮抗剂) |
| M. Wt | 549.02 |
| Formula | C29H32ClF3N2O3 |
| Purity | >99% |
| Storage | Store lyophilized at -20ºC, keep desiccated. |
| CAS No. | 913358-93-7 |
| SMILES | CNC(=O)[C@@H](C1=CC=CC=C1)N2CCC3=CC(=C(C=C3[C@@H]2CCC4=CC=C(C=C4)C(F)(F)F)OC)OC.Cl |
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