Gpi-1485
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基本情報
- CAS
186268-78-0- 標準SMILES
CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)O- InChIKey
FOPALECPEUVCTL-QMMMGPOBSA-N- 分子式
- C12H19NO4
- 平均分子量
- 241.28 g/mol
- 単同位体質量
- 241.13140809
概要
GPI 1485 is a product candidate that belongs to a class of small molecule compounds called neuroimmunophilin ligands. In preclinical experiments, neuroimmunophilin ligands have been shown to repair and regenerate damaged nerves without affecting normal, healthy nerves. GPI 1485 is being studied in phase 2 clinical trials for the treatment of Parkinson's disease and post-prostatectomy erectile dysfunction and in pre-clinical development for HIV related dementia and neuropathy.
名称と識別子
- 優先名称
- Gpi-1485
- IUPAC
- (2S)-1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carboxylic acid
- 英語名
- (2S)-1-(1',2'-DIOXO-3',3'-DIMETHYL-PENTYL)-2-PYRROLIDINE-CARBOXYLIC ACID
- 分子式
- C12H19NO4
- 分子量
- 241.28
名称と別名
186268-78-0GPI-1485GPI 1485L-Proline, 1-(3,3-dimethyl-1,2-dioxopentyl)-(2S)-1-(1,2-DIOXO-3,3-DIMETHYLPENTYL)-2-PYRROLIDINECARBOXYLIC ACIDUNII-0709BVY57W0709BVY57W1-(1,2-Dioxo-3,3-dimethylpentyl)-2-pyrrolidine carboxylic acid, 2S(2S)-1-(3,3-DIMETHYL-2-OXOPENTANOYL)-2-PYRROLIDINECARBOXYLIC ACIDNIL-A cpdNIL-A1 cpdNIL-A2 cpd
名称をさらに表示
GPI-1485 LGPI-1485, 10 mM in DMSO(2S)-1-(3,3-Dimethyl-2-oxopentanoyl)-pyrrolidine-2-carboxylic acid(2S)-1-(1',2'-DIOXO-3',3'-DIMETHYL-PENTYL)-2-PYRROLIDINE-CARBOXYLIC ACIDneurofunctional,regeneration,Inhibitor,ligand,stroke,GPI-1485,GPI 1485,inhibit,immunophilin,neural,GM 1485,GM-1485,GPI1485
NIL-A3 cpdRefChem:144222GPI1485GM1485848859-43-8(2S)-1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carboxylic acid(S)-1-(3,3-Dimethyl-2-oxopentanoyl)pyrrolidine-2-carboxylic acidMFCD02179274
物性
構造計算による物性補完中
- XLogP
- 1.5
- 極性表面積
- 74.7 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 4
- 回転可能結合数
- 4
- 重原子数
- 17
- 形式電荷
- 0
- 複雑度
- 348
実験および物理化学的性質
DrugsPharmaceuticals -> Listed in ZINC15
物理化学的性質
- 沸点
- 386.2 · 386.2±52.0 °C(Predicted)
- 比重(密度)
- 1.188 · 1.188±0.06 g/cm3(Predicted)
- 貯蔵温度
- -20 °C · Store at -20°C
- 溶解性
- Soluble in DMSO
- 酸解離定数(Pka)
- 3.25 · 3.25±0.20(Predicted)
- 外見
- Solid
- 色
- White to light yellow
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 4 (100%)
安全データ
- hs_code
- 2933998090
化学と産業
薬理情報
Mechanism of Action
GPI 1485 belongs to a class of small molecule compounds called neuroimmunophilin ligands which are a family of binding proteins that are highly conserved in nature and mediate the actions of immunosuppressant drugs. The FK-506-binding protein (FKBP) subclass of immunophilin bind FK-506 and rapamycin and are of particular interest due to their potent neurotrophic activity.
関連反応
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