THR-β agonist 3
HIT214433770
sdf文件结构编辑类似物检索
HIT ID: HIT214433770
Cas No: 2656400-84-7
分子式: C29H32ClO5P
分子量: 526.99
常用名: THR-β agonist 3
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4S)-4-(3-chlorophenyl)-2-({[(1R)-1-[4-hydroxy-3-(propan-2-yl)phenyl]-7-methyl-2,3-dihydro-1H-inden-5-yl]oxy}methyl)-1,3,2lambda5-dioxaphosphinan-2-one
IUPAC: (4S)-4-(3-chlorophenyl)-2-({[(1R)-1-[4-hydroxy-3-(propan-2-yl)phenyl]-7-methyl-2,3-dihydro-1H-inden-5-yl]oxy}methyl)-1,3,2lambda5-dioxaphosphinan-2-one
SMILES: CC(C)c1cc(ccc1O)[C@H]1CCc2cc(OCP3(=O)OCC[C@H](O3)c3cccc(Cl)c3)cc(C)c12
SMILES: CC(C)c1cc(ccc1O)[C@H]1CCc2cc(OCP3(=O)OCC[C@H](O3)c3cccc(Cl)c3)cc(C)c12
InChI key: WZCDYBOIHFQXJO-ZVVILAFBSA-N
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