Integrase-LEDGF/p75 allosteric inhibitor 1
HIT214434550
sdf文件结构编辑类似物检索
HIT ID: HIT214434550
Cas No: 1431738-14-5
分子式: C33H41NO6S
分子量: 579.75
常用名: Integrase-LEDGF/p75 allosteric inhibitor 1
常用名: Integrase-LEDGF/p75 allosteric inhibitor 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(tert-butoxy)-2-[2-methanesulfonamido-3,3',4',6-tetramethyl-5-(5-methyl-3,4-dihydro-2H-1-benzopyran-6-yl)-[1,1'-biphenyl]-4-yl]acetic acid
IUPAC: 2-(tert-butoxy)-2-[2-methanesulfonamido-3,3',4',6-tetramethyl-5-(5-methyl-3,4-dihydro-2H-1-benzopyran-6-yl)-[1,1'-biphenyl]-4-yl]acetic acid
SMILES: Cc1ccc(cc1C)-c1c(C)c(-c2ccc3OCCCc3c2C)c(C(OC(C)(C)C)C(O)=O)c(C)c1NS(C)(=O)=O
SMILES: Cc1ccc(cc1C)-c1c(C)c(-c2ccc3OCCCc3c2C)c(C(OC(C)(C)C)C(O)=O)c(C)c1NS(C)(=O)=O
InChI key: JCQVWFOOYKCORR-UHFFFAOYSA-N
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