| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| O612590-5mg |
5mg |
期货  |
| |
| O612590-25mg |
25mg |
期货 |
|
| 别名 | 氧苯甲胺 |
|---|---|
| 英文别名 | Methocidin | Methocidine [INN-French] | Oxyphenonium cation | OXYPHENONIUM [VANDF] | SCHEMBL250614 | BRD-A14208071-004-10-7 | CHEBI:94329 | NCGC00018256-05 | OXYPHENONIUM [WHO-DD] | D2G5508Y7I | UNII-D2G5508Y7I | 2-{[cyclohexyl(hydroxy)phenylacetyl]oxy}-N |
| 规格或纯度 | Moligand™ |
| 英文名称 | oxyphenonium |
| 作用类型 | 拮抗剂 |
| 作用机制 | M 4 受体拮抗剂 |
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| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
| 分子类型 | 小分子 |
|---|---|
| IUPAC Name | {2-[(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxy]ethyl}diethylmethylazanium |
| INCHI | InChI=1S/C21H34NO3/c1-4-22(3,5-2)16-17-25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6,8-9,12-13,19,24H,4-5,7,10-11,14-17H2,1-3H3/q+1 |
| InChi Key | GFRUPHOKLBPHTQ-UHFFFAOYSA-N |
| Canonical SMILES | CC[N+](CCOC(=O)C(c1ccccc1)(C1CCCCC1)O)(CC)C |
| Isomeric SMILES | CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O |
| PubChem CID | 5749 |
| 分子量 | 348.500 g/mol |
|---|---|
| XLogP3 | 4.100 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 3 |
| 可旋转键计数Rotatable Bond Count | 9 |
| 精确质量Exact Mass | 348.254 Da |
| 单同位素质量Monoisotopic Mass | 348.254 Da |
| 拓扑极表面积Topological Polar Surface Area | 46.500 Ų |
| 重原子数Heavy Atom Count | 25 |
| 形式电荷Formal Charge | 1 |
| 复杂度Complexity | 409.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 0 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 1 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
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