Name: YM-355179
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT214318800
Cas No:887647-69-0
常用名:YM-355179
别名:YM 355179
IUPAC:(2E)-but-2-enedioic acid; N-[(3R)-1-[(6-fluoronaphthalen-2-yl)methyl]pyrrolidin-3-yl]-2-[1-(3-hydroxy-5-methylpyridine-2-carbonyl)piperidin-4-ylidene]acetamide
IUPAC:(2E)-but-2-enedioic acid; N-[(3R)-1-[(6-fluoronaphthalen-2-yl)methyl]pyrrolidin-3-yl]-2-[1-(3-hydroxy-5-methylpyridine-2-carbonyl)piperidin-4-ylidene]acetamide
InChI key:UVJWZUCQVIYFLT-FMYYAHIMSA-N

分子式:C33H35FN4O7
分子量:618.662
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[#8]-[#6](=O)\[#6]=[#6]\[#6](-[#8])=O.[#6]-c1cnc(-[#6](=O)-[#7]-2-[#6]-[#6]\[#6](-[#6]-[#6]-2)=[#6]\[#6](=O)-[#7]-[#6@@H]-2-[#6]-[#6]-[#7](-[#6]-c3ccc4cc(F)ccc4c3)-[#6]-2)c(-[#8])c1
SMILES:[#8]-[#6](=O)\[#6]=[#6]\[#6](-[#8])=O.[#6]-c1cnc(-[#6](=O)-[#7]-2-[#6]-[#6]\[#6](-[#6]-[#6]-2)=[#6]\[#6](=O)-[#7]-[#6@@H]-2-[#6]-[#6]-[#7](-[#6]-c3ccc4cc(F)ccc4c3)-[#6]-2)c(-[#8])c1

YM-355179 is a novel, selective antagonist of CC chemokine receptor 3 with oral activity.

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