Name: Epelsiban besylate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214319421
Cas No:1159097-48-9
常用名:Epelsiban besylate
别名:GSK-557296B, GSK557296B
IUPAC:(6R)-6-[(2S)-butan-2-yl]-3-(2,3-dihydro-1H-inden-2-yl)-1-[(1S)-1-(2,6-dimethylpyridin-3-yl)-2-(morpholin-4-yl)-2-oxoethyl]piperazine-2,5-dione; benzenesulfonic acid
IUPAC:(6R)-6-[(2S)-butan-2-yl]-3-(2,3-dihydro-1H-inden-2-yl)-1-[(1S)-1-(2,6-dimethylpyridin-3-yl)-2-(morpholin-4-yl)-2-oxoethyl]piperazine-2,5-dione; benzenesulfonic acid
InChI key:BEWUOCYETMDWGE-YYMNEDJGSA-N

分子式:C36H44N4O7S
分子量:676.83
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OS(=O)(=O)c1ccccc1.[H][C@]1([C@@H](C)CC)N([C@H](C(=O)N2CCOCC2)c2ccc(C)nc2C)C(=O)C(NC1=O)C1Cc2ccccc2C1 |@:40|
SMILES:OS(=O)(=O)c1ccccc1.[H][C@]1([C@@H](C)CC)N([C@H](C(=O)N2CCOCC2)c2ccc(C)nc2C)C(=O)C(NC1=O)C1Cc2ccccc2C1 |@:40|

Epelsiban Besylate is an oral drug that is a highly selective anamol oxytocin receptor antagonist.

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