Sulfo-SIAB
HIT212668358
sdf文件结构编辑类似物检索
HIT ID: HIT212668358
Cas No: 106145-13-5
分子式: C13H11IN2O8S
分子量: 482.2
常用名: Sulfo-SIAB
氢键受体数 (HBA): 7
氢键供体数 (HBD): 2
LogP: 0.68329805
IUPAC: 1-[4-(2-iodoacetamido)benzoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
IUPAC: 1-[4-(2-iodoacetamido)benzoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
SMILES: OS(=O)(=O)C1CC(=O)N(OC(=O)c2ccc(NC(=O)CI)cc2)C1=O
SMILES: OS(=O)(=O)C1CC(=O)N(OC(=O)c2ccc(NC(=O)CI)cc2)C1=O
InChI key: CULQNACJHGHAER-UHFFFAOYSA-N
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