Name: MK-0736 hydrochloride
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT220912808
Cas No:719274-77-8
常用名:MK-0736 hydrochloride
IUPAC:3-{4-[3-(ethanesulfonyl)propyl]bicyclo[2.2.2]octan-1-yl}-4-methyl-5-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazole hydrochloride
IUPAC:3-{4-[3-(ethanesulfonyl)propyl]bicyclo[2.2.2]octan-1-yl}-4-methyl-5-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazole hydrochloride
InChI key:InChIKey=QBGALRQCQBVUST-UHFFFAOYSA-N

分子式:C23H31ClF3N3O2S
分子量:506.03
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cl.CCS(=O)(=O)CCCC12CCC(CC1)(CC2)c1nnc(-c2ccccc2C(F)(F)F)n1C
SMILES:Cl.CCS(=O)(=O)CCCC12CCC(CC1)(CC2)c1nnc(-c2ccccc2C(F)(F)F)n1C

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