Name: HQL-79
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT211999932
Cas No:162641-16-9
常用名:HQL-79
IUPAC:4-(diphenylmethoxy)-1-[3-(1H-1,2,3,4-tetrazol-5-yl)propyl]piperidine
IUPAC:4-(diphenylmethoxy)-1-[3-(1H-1,2,3,4-tetrazol-5-yl)propyl]piperidine
InChI key:TZQGXAHOROZEKN-UHFFFAOYSA-N

分子式:C22H27N5O
分子量:377.492
氢键供体数 (HBD):1
氢键受体数 (HBA):5
LogP:1.2351725
SMILES:C(CN1CCC(CC1)OC(c1ccccc1)c1ccccc1)Cc1nnn[nH]1
SMILES:C(CN1CCC(CC1)OC(c1ccccc1)c1ccccc1)Cc1nnn[nH]1

HQL-79 is a selective and orally active human hematopoietic prostaglandin D synthase (H-PGDS) inhibitor. It inhibits the synthesis of PGD2 and acts as an anti-allergic agent (Kd: 0.8 μM and IC50: 6 μM). It also shows no obvious effect on COX-1, COX-2, m-PGES, or L-PGDS.

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