AGN 191864
HIT212714475
sdf文件结构编辑类似物检索
HIT ID: HIT212714475
Cas No: 169702-47-0
分子式: C22H26O2S
分子量: 354.51
常用名: AGN 191864
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: 7.1557984
IUPAC: 5-[(1E)-2-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethenyl]thiophene-2-carboxylic acid
IUPAC: 5-[(1E)-2-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethenyl]thiophene-2-carboxylic acid
SMILES: Cc1cc2c(cc1\C=C\c1ccc(s1)C(O)=O)C(C)(C)CCC2(C)C
SMILES: Cc1cc2c(cc1\C=C\c1ccc(s1)C(O)=O)C(C)(C)CCC2(C)C
InChI key: ABLIGCMMHQVGHP-VOTSOKGWSA-N
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