2-(2,4-Dichlorobenzyl)thioadenosine
HIT214433497
sdf文件结构编辑类似物检索
HIT ID: HIT214433497
Cas No: 2095417-37-9
分子式: C17H17Cl2N5O4S
分子量: 458.31
常用名: 2-(2,4-Dichlorobenzyl)thioadenosine
常用名: 2-(2,4-Dichlorobenzyl)thioadenosine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R,3R,4S,5R)-2-(6-amino-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC: (2R,3R,4S,5R)-2-(6-amino-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SMILES: Nc1nc(SCc2ccc(Cl)cc2Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
SMILES: Nc1nc(SCc2ccc(Cl)cc2Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
InChI key: GHSJUTIELLTXHS-XNIJJKJLSA-N
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